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1996 年度 研究成果報告書概要

有機金属共役系の構築と物性への展開

研究課題

研究課題/領域番号 06101004
研究種目

特別推進研究

配分区分補助金
審査区分 化学系
研究機関大阪大学 (1995-1996)
岡崎国立共同研究機構 (1994)

研究代表者

中村 晃  大阪大学, 大学院・理学研究科, 教授 (80029404)

研究分担者 武田 定  群馬大学, 工学部, 助教授 (00155011)
森 和亮  神奈川大学, 理学部, 教授 (60029709)
岡村 高明  大阪大学, 大学院・理学研究科, 助手 (90252569)
中野 雅由  大阪大学, 大学院・理学研究科, 助手 (80252568)
山口 兆  大阪大学, 大学院・理学研究科, 教授 (80029537)
研究期間 (年度) 1994 – 1996
キーワード有機金属共役系 / 金属-金属多重結合 / 水素結 / 磁性 / 固体NMR / 分子軌道計算 / 非線形光学 / dπ-pπ相互作用
研究概要

新しい有機金属共役系として様々なM′-M-M-M′型の直線状多重結合系錯体(M′=Pd,Pt;M=Cr,Mo)を系統的に合成した。これらのうち、Mo_2Pd_2四核錯体の三次の非線形光学定数χ^<(3)>を測定すると1.2×10^9(esu)であり、有機系で最も大きいχ^<(3)>をもつポリジアセチレンと同程度の大きな非線形光学特性を示した。
遷移金属(Zr,Ru)が共役ポリエンに結合した錯体を合成し、シクロペンタジエニル(Cp)基を有するジルコニウムのs-トランス-ジエンおよびトリエン錯体が顕著なサーモクロミズムを示すことが見いだされた。低温固体NMRにより、これがCp環のトンネル回転に起因することを明らかにした。
有機金属共役系の結合様式の理論化学的解明のため,Cr(II)およびMo(II)の2核錯体の結合軸方向に遷移金属がさらに2つ結合した4核錯体について可能な結合様式をとりあげ、ab initio法により,解析した.磁気的性質に関しては,有効交換積分J値の算出を行い,可能な磁性相について検討した.d-d共役系では,non dynamical電子相関を考慮したUNO CAS CI,CASSCFで精度の良い計算が行えることが判明したが,d-p共役系ではさらにdynamical子電相関が必要なことが示唆された.
窒素、酸素、メタンなどの気体を大量に吸蔵する細孔を持ったジカルボン酸Cu(II)を多数合成した。同様の細孔を持つMo(II),Ru(II,III)の化合物の合成にも成功した。Mo(II)の化合物には僅かながら電気伝導性があり、-Mo≡Mo-Mo≡Mo-一次元鎖の存在の可能性を示した。
NH…S、NH…O水素結合共役系と金属イオンを複合化させ、水素結合-遷移金属共役系を構築した。水素結合は化学的性質にだけでなく、磁気的相互作用の制御を行なうなど物性面にも十分に寄与のあることを示した。

  • 研究成果

    (201件)

すべて その他

すべて 文献書誌 (201件)

  • [文献書誌] M.Nakano, K.Yamaguchi: "Theoretical Studies for Third-order Hyperpolarizabilities of Alternantand Condenced-ring Conjugated SystemsI." Mol.Cryst.Liq.Cryst.255. 139-148 (1994)

    • 説明
      「研究成果報告書概要(和文)」より
  • [文献書誌] K.Mashima, H.Sugiyama, A.Nakamura: "Diene Complex of Lanthanum : The Crystal Structure of a Diene-bridged Dilanthanum Complex,[LaI_2(thf)_3(μ-η^4:η^4:-PhCH=CHCH=CHPh)LaI_2(thf)_3]." J.Chem.Soc.,Chem.Commun.1994. 1581-1582 (1994)

    • 説明
      「研究成果報告書概要(和文)」より
  • [文献書誌] K.Mashima, S.Fujikawa, H.Urata, E.Tanaka, A.Nakamura: "Polyethylene with Extremely Narrow Polydispersity Obtained from the New Catalyst SystemsNb(η^5-C_5Me_5)(η^4-diene)Cl_2-MAO and Nb(η^5-C_5Me_5)(η^4-diene)_2MAO." J.Chem.Soc.,Chem.Commun.1994. 1623-1624 (1994)

    • 説明
      「研究成果報告書概要(和文)」より
  • [文献書誌] N.Ueyama, M.Kondo, H.Oku, A.Nakamura: "Structure and Properties of (NEt_4)_2[MoIVO(α,2-toluenedithiolato)_2]." Bull.Chem.Soc.Jpn.67. 1840-1847 (1994)

    • 説明
      「研究成果報告書概要(和文)」より
  • [文献書誌] S.Yamanaka, T.Kawamura, T.Noro K.Yamaguchi: "Heisenberg Model for Radical Reactions.Part 3.Direct Exchange Coupling between Transition Metal Ions and Triplet Methylene." J.Mol.Struct.(Theochem). 310. 185-196 (1994)

    • 説明
      「研究成果報告書概要(和文)」より
  • [文献書誌] S.Yamanaka, M.Okumura, M.Nakano, K.Yamaguchi: "EHF Theory of Chemical Reactions.Part 4.UNO CASSCF,UNO CASPT2 and R(U)HF Coupled-cluster (CC) Wavefunctions." J.Mol.Struct.(Theochem). 310. 205-218 (1994)

    • 説明
      「研究成果報告書概要(和文)」より
  • [文献書誌] H.Oku, N.Ueyama, M.Kondo, A.Nakamura: "Oxygen Atom Transfer Systems in Which the (μ-Oxo) dimolybdenum (V) Complex Formation Does Not Occur : Syntheses,Structures,and Reactivities of Monooxomolybdenum (IV) Benzenedithiolato Complexes as Models of Molybdenum Oxidoreductases." Inorg.Chem.33. 209-216 (1994)

    • 説明
      「研究成果報告書概要(和文)」より
  • [文献書誌] S.Yamanaka, T.Kawakami, H.Nagao, K.Yamaguchi: "Effective Exchange Integrals for Open-shell Species by Density Functional Method." Chem.Phys.Lett.231. 25-33 (1994)

    • 説明
      「研究成果報告書概要(和文)」より
  • [文献書誌] K.Mashima, Y.Nakayama, H.Fukumoto, N.Kanehisa, Y.Kai, A.Nakamura: "Formation of Lanthanoid(II) and Lanthanoid(III) Thiolate Complexes Derived from Metals and Organic Disulfides : Crystal Structures of [{Ln(SAr)(μ-SAr)(thf)_3}_2](Ln=Sm,Eu),[Sm(SAr)_3(py)_2(thf)]and[Yb(SAr)_3(py)_3](Ar=2,4,6-Triisopropylphenyl ; py=Pyridine)." J.Chem.Soc.,Chem.Commun.1994. 2523-2524 (1994)

    • 説明
      「研究成果報告書概要(和文)」より
  • [文献書誌] M.Nakano, K.Yamaguchi, T.Fueno: "Coupled Hartree-Fock Calculations of the Third-order Hyperpolarizabilities for Mixed and Segregated Charge-transfer Clusters." Nonlinear Optics. 6. 289-296 (1994)

    • 説明
      「研究成果報告書概要(和文)」より
  • [文献書誌] M.Nakano, K.Yamaguchi: "Numerical Liouville Approach : A Calculation Method for Nonlinear Optical Susceptibilities of N-state Systems." Phys.Rev.50. 2989-3004 (1994)

    • 説明
      「研究成果報告書概要(和文)」より
  • [文献書誌] K.Mashima, A.Nakamura: "Living Polymerization of Ethylene by Organometallic Complexes" 触媒. 1994. 572-579 (1994)

    • 説明
      「研究成果報告書概要(和文)」より
  • [文献書誌] H.Oku, N.Ueyama, A.Nakamura, Y.Kai, N.Kanehisa: "The Stablization of Dioxomolybdenum(VI) Dithiolene Complex by the Electron Withdrawing Substituent on the Dithiolene Ligand : Comparison of Reactivities of Monooxomolybdenum(IV) Complex with R_2S_2C_2(R=-CN and -COOMe) Ligands as Models of Molybdenum Oxidoreductases." Chem.Lett.1994. 607-610 (1994)

    • 説明
      「研究成果報告書概要(和文)」より
  • [文献書誌] K.Mashima, H.Sugiyama, N.Kanehisa, Y.Kai, H.Yasuda, A.Nakamura: "Diene Complexes of Calcium and Strontium : First Crystal Structures of Calcium- and Strontium-Diene Complexes,M(2,3-dimethyl-1,4-diphenyl-1,3-butadiene)(THF)_4(M=Ca and Sr)." J.Am.Chem.Soc.116. 6977-6978 (1994)

    • 説明
      「研究成果報告書概要(和文)」より
  • [文献書誌] T.Tsunekawa, K.Yamaguchi: "Theoretical Studies on Hydrogen Bonding Interactions and Electronic Polarizations and Clustero3,9-Dinitro-5a,-6,11a,12-tetrahydro[1,4]benzoxazino[3,2-b][1,4]benzoxazine." J.Phys.Chem.98. 785-791 (1994)

    • 説明
      「研究成果報告書概要(和文)」より
  • [文献書誌] K.Mashima, Y.Nakayama, A.Nakamura, N.Kanehisa, Y.Kai, H.Takaya: "A New Convenient Preparation of Monocyclooctatetraenyl-lanthanide Complexes from Metallic Lanthanides and Oxidants." J.Organomet.Chem.473. 85-91 (1994)

    • 説明
      「研究成果報告書概要(和文)」より
  • [文献書誌] M.Fujiwara, S.Takamizawa, W.Mori, K.Yamaguchi: "Molecular Design and Synthsis of Ferro-and Ferri Magnetic Inorganic Polymers and Complexes with Tetrathiolate Ligands." Mol.Cyst.Liq.Cryst.279. 1-8 (1995)

    • 説明
      「研究成果報告書概要(和文)」より
  • [文献書誌] T.Daniel, H.Nagao, K.Tanaka, A.Nakamura: "Norbornadiene(bipyridy) molybdenum(II) Complexes Synthesis,Structure and Reactivity of [Mo(CO)(C_7H_8)(C_<10>H_6R_2N_2)X_2](X=I,Br)." Chem.Ber.128. 1007-1013 (1995)

    • 説明
      「研究成果報告書概要(和文)」より
  • [文献書誌] T.Daniel, N.Suzuki, K.Tanaka, A.Nakamura: "Fluxional Behavior of Tert-butyl-substituted 2,2' : 6"2"-Terpyridylmolybdenum(0) and 2,2'-Bipyridylmolybdenum(II) Complexes : Enhanced Solubility and Ease in NMR Study Caused by the Tert-butyl Group." J.Organomet.Chem.505. 109-117 (1995)

    • 説明
      「研究成果報告書概要(和文)」より
  • [文献書誌] W.Mori, K.Yamaguchi: "Spin Glass Behavior of Synthetic Atacamite Cu_2Cl(OH)_3." Mol.Cryst.Liq.Cryst.274. 113-118 (1995)

    • 説明
      「研究成果報告書概要(和文)」より
  • [文献書誌] T.Kawakami, S.Yamanaka, H.Nagao, W.Mori, M.Kamachi, K.Yamaguchi: "Theoretical approaches to molecular magnetism II : No-overlap and orientation principlesforferromagneticinteractions." Mol.Cryst.Liq.Cryst.272. 117- (1995)

    • 説明
      「研究成果報告書概要(和文)」より
  • [文献書誌] S.Takeda, T.Inabe, T.Mitani, Y.Maruyama, K.Yamaguchi: "ESR Study on the Charge Transfer Complexes of N-Salicylideneanilines containing NHO Hydrogen bond as a Dynamic Function." Synt.Metals. 70. 1211-1212 (1995)

    • 説明
      「研究成果報告書概要(和文)」より
  • [文献書誌] S.Takeda, T.Inabe, T.Mitani, Y.Maruyama, K.Yamaguchi: "ESR Study on the Charge Transfer Complexes of N-Salicylideneanilines containing NHO Hydrogen bond as a Dynamic Function." Synt.Metals. 70. 1211-1212 (1995)

    • 説明
      「研究成果報告書概要(和文)」より
  • [文献書誌] A.Nakamura: "Organometallicp-Conjugated Systems." Bull.Chem.Soc.Jpn.68. 1515-1521 (1995)

    • 説明
      「研究成果報告書概要(和文)」より
  • [文献書誌] M.Nakano, S.Yamada, K.Yamaguchi: "Theoretical Studies on Hyperpolarizabilitiues of Nitroxide SpeciesI." Synt.Metals. 71. 1691-1692 (1995)

    • 説明
      「研究成果報告書概要(和文)」より
  • [文献書誌] Y.Matuzaki, M.Nakano, K.Yamaguchi, K.Tanaka, T.Yamabe: "Secondhyperpolarizabilies of p-conjugatedsilicon-ringpolymers." Synt.Metals. 71. 1737-1738 (1995)

    • 説明
      「研究成果報告書概要(和文)」より
  • [文献書誌] W.Y.Sun, T.Ueno, N.Ueyama, A.Nakamura: "^<19>FNMR Investigations of Cobalt(II) Complexes with Cysteine-Containing Peptide Ligands." Magn.Reson.Chem.33. 174-177 (1995)

    • 説明
      「研究成果報告書概要(和文)」より
  • [文献書誌] M.Fujiwara, W.Mori, K.Yamaguchi: "Iron-schiff Base Magnetic Polymers.Synthesis and Characterization." Mol.Cryst.Liq.Cryst.274. 175-178 (1995)

    • 説明
      「研究成果報告書概要(和文)」より
  • [文献書誌] K.Mashima, Y.Tanaka, A.Nakamura: "Synthesis,Characterization,and Reaction of Ethylene Complexesbearing Ta(η^5-C_5R_5)(η^4-buta-1,3-diene) Fragments (R=H,Me)." J.Organomet.Chem.502. 19-23 (1995)

    • 説明
      「研究成果報告書概要(和文)」より
  • [文献書誌] S.Yamanaka, T.Kawakami, H.Nagao, K.Yamaguchi: "Theoretical studies of spin populations on nitronylnitroxide,phenylnitronylnitroxide and p-NPNN." Mol.Cryst.Liq.Cryst.271. 19- (1995)

    • 説明
      「研究成果報告書概要(和文)」より
  • [文献書誌] M.Kitazawa, M.Takahashi, T.Wada, H.Sasabe, M.Nakano, K.Yamaguchi: "Theoretical Evaluation of Hyperpolarizability of L-2-pyrrolidone-5-carboxylic Acid (L-PCA)." Bull.Chem.Soc.Jpn.68. 2215-2224 (1995)

    • 説明
      「研究成果報告書概要(和文)」より
  • [文献書誌] S.Yamanaka, T.Kawakami, M.Okumura, K.Yamaguchi: "CASSCF and CASPT2 calculations of hole-doped polycarbenes.Possibilities of organic ferromagneticconductorsandmetals." Chem.Phys.Lett.233. 257- (1995)

    • 説明
      「研究成果報告書概要(和文)」より
  • [文献書誌] A.Nakamura, K.Mashima: "Recent Progress in the Chemistry of 1,3-Diene Complexes of Niobium and Tantalum." J.Organomet.Chem.500. 261-267 (1995)

    • 説明
      「研究成果報告書概要(和文)」より
  • [文献書誌] K.Mashima, T.Shibahara, Y.Nakayama, A.Nakamura: "Synthesis and Characterization of Cationic Pyridine-2-thiolate Complexes of Lanthanoid(III) : Crystal Structures of Pentagonal Bipyramidal [Ln(SC_5H_4N)_2(hmpa)_3]I(Ln=Sm,Yb ; hmpa=hexamethylphosphoric triamide)." J.Organomet.Chem.501. 263-269 (1995)

    • 説明
      「研究成果報告書概要(和文)」より
  • [文献書誌] K.Mashima, S.Fujikawa, Y.Tanaka, Y.Urata, T.Oshiki, E.Tanaka, A.Nakamura: "Living Polymerization of Ethylene Catalyzed by Diene Complexes of Niobium and Tantalum,M(η^5-C_5Me_5)(η^4-diene)X_2 and M(η^5-C_5Me_5)(η^4-diene)_2(M=Nb and Ta) in the Presence of Methylaluminoxane." Organometallics. 14. 2633-2640 (1995)

    • 説明
      「研究成果報告書概要(和文)」より
  • [文献書誌] S.Yamanaka, T.Kawakami, S.Yamada, H.Nagao, M.Nakano, K.Yamaguchi: "Theoretical studies of spin density populations on nitroxide and nitronylnitroxide derivatives." Chem.Phys.Lett.240. 268-277 (1995)

    • 説明
      「研究成果報告書概要(和文)」より
  • [文献書誌] R.Hahn, A.Nakamura, K.Tanaka, Y.Nakayama: "Synthesis and Molecular Structure of a Pentacoordinated Nickel(II) Complex with a Mixed S_2N_3 Coordination Sphere." Chem.Phys.Lett.240. 268-277 (1995)

    • 説明
      「研究成果報告書概要(和文)」より
  • [文献書誌] M.Nakano, K.Yamaguchi, Y.Matuzaki, K.Tanaka, T.Yamabe: "Numerical Liouville Approach : Formulation of Third-order Nonlinear Optical Susceptibilities." J.Chem.Phys.102. 2986-2995 (1995)

    • 説明
      「研究成果報告書概要(和文)」より
  • [文献書誌] M.Nakano, K.Yamaguchi, Y.Matuzaki, K.Tanaka, T.Yamabe: "Numerical Liouville Approach : Three-type Analysis of Virtual Excitation Processes of Third-order Nonlinear Optical Spectrain Third-harmonic Generation." J.Chem.Phys.102. 2996-3004 (1995)

    • 説明
      「研究成果報告書概要(和文)」より
  • [文献書誌] H.Zaima, N.Ueyama, H.Adachi, A.Nakamura: "^1H-,^<13>C-,and ^<113>Cd-NMR Study of the Cd(II) Complex of a Blocked Peptide,Z-Cys-Ala-Pro-His-OMe,in Organic Solvents." Biopolymers. 35. 319-329 (1995)

    • 説明
      「研究成果報告書概要(和文)」より
  • [文献書誌] M.Nakano, K.Yamaguchi: "Numerical Liouville Approach : Intensity Dependent Transient Linear and Nonlinear Optical Susceptibilities." Chem.Phys.Lett.234. 323-323 (1995)

    • 説明
      「研究成果報告書概要(和文)」より
  • [文献書誌] H.Oku, N.Ueyama, A.Nakamura: "Thiolato-Activated Oxo-Metal Bond Features in Molybdenum and Tungsten Oxidoreductase Models As Revealed by Raman Spectroscopy." Inorg.Chem.34. 3667-3676 (1995)

    • 説明
      「研究成果報告書概要(和文)」より
  • [文献書誌] S.Nagatomo, S.Takeda, K.Yamaguchi, M.Iwata, Y.Ishibashi: "New Cation Duffusing Phase of (CH_3NH_3)_5Bi_2Cl_<11>." J.Phys.Soc.Jpn.64. 391-394 (1995)

    • 説明
      「研究成果報告書概要(和文)」より
  • [文献書誌] M.Nakano, K.Yamaguchi, Y.Matuzaki, K.Tanaka, T.Yamabe: "Numerical Liouville Approach : Third-order Nonlinear Optical Susceptibilities in THG,EFISH and DFWM." Chem.Phys.Lett.233. 411-419 (1995)

    • 説明
      「研究成果報告書概要(和文)」より
  • [文献書誌] T.Kawakami, S.Yamanaka, W.Mori, K.Yamaguchi, A.Kajiwara, M.Kamachi: "No-overlap and orientation principle for ferromagneticinteractions between nitroxide groups." Chem.Phys.Lett.235. 414- (1995)

    • 説明
      「研究成果報告書概要(和文)」より
  • [文献書誌] M.Nakano, I.Shigemoto, S.Yamada, K.Yamaguchi: "Size-consistent Approach and Density Analysis of Hyperpolarizability : Second Hyperpolarizabilities of Polymeric Systems with and without Defects." J.Chem.Phys.103. 4175-4191 (1995)

    • 説明
      「研究成果報告書概要(和文)」より
  • [文献書誌] N.Ueyama, T.-A.Okamura, Y.Yamada, A.Nakamura: "Crystal and Solution Structure of Novel Bulky Bis[2,6-di(acylamino)phenyl] Disulfides.Absence of Covalent NH・・・S Hydrogen Bond between Amide NH and Neighboring Disulfide in Bis[2,6-di(pivaloylamino)phenyl] Disulfide." J.Org.Chem.60. 4893-4899 (1995)

    • 説明
      「研究成果報告書概要(和文)」より
  • [文献書誌] K.Mashima, Y.Tanaka, A.Nakamura: "Synthesis,Characterization,and Reactionsofa Mononuclear Tantalum-benzyne Complex,Ta(η^5-C_5Me_5)(η^4-C_4H_6)(η^2-C_6H_4)." Organometallics. 14. 5642-5651 (1995)

    • 説明
      「研究成果報告書概要(和文)」より
  • [文献書誌] H.Oku, N.Ueyama, A.Nakamura: "Electronic and Steric Effect of Bulky Triphenyl Substituent in the Monooxobenzenedithiolatomolybdenum(V) Complex and the Tungsten Analogas Models" Chem.Lett.1995. 621-622 (1995)

    • 説明
      「研究成果報告書概要(和文)」より
  • [文献書誌] D.Yamaki, S.Yamada, G.Maruta, T.Kawakami, W.Mori, K.Yamaguchi: "Theoretical Calculation of Effective Exchange Integrals for One- and Two- Dimensional Poly(phynylenemethylene) Systems.Possibilities of Organic Ferro- and Ferri- Magnetic Solids." Mol.Cryst.Liq.Cryst.279. 9-18 (1995)

    • 説明
      「研究成果報告書概要(和文)」より
  • [文献書誌] H.Oku, N.Ueyama, A.Nakamura: "Benzoin Oxidation at Extreme Temperature by Bis(1,2-benzenedithiolato)dioxotungsteate(VI) Complex : A Model Study for Hyperthermostable Tungsten Oxidoreductases" Chem.Lett.1996. 1131-1132 (1996)

    • 説明
      「研究成果報告書概要(和文)」より
  • [文献書誌] M.Kondo, H.Oku, N.Ueyama, A.Nakamura: "Synthesis and Properties of a Nitridomolybdenum(VI) Complex Having Benzenedithiolate Ligands.Effect of the Thiolate on the Activation of the Nitrido Ligand." Bull.Chem.Soc.Jpn.69. 117-123 (1996)

    • 説明
      「研究成果報告書概要(和文)」より
  • [文献書誌] Y.Matsuzaki, M.Nakano, K.Yamaguchi, K.Tanaka, T.Yamabe: "Third-order opticalnonlinearlity in new p-conjugated polymers : polydiethynylsilane and polysilole." Chem.Phys.Lett.263. 119-125 (1996)

    • 説明
      「研究成果報告書概要(和文)」より
  • [文献書誌] N.Ueyama, N.Nishikawa, Y.Yamada, T.A.Okamura, A.Nakamura: "Cytochrome P-450 Model(Prophinato)(thiolato)iron(III) Complexes with Single and Double NH・・・S Hydrogen Bonds at the Thiolate Site." J.Am.Chem.Soc.118. 12826-12827 (1996)

    • 説明
      「研究成果報告書概要(和文)」より
  • [文献書誌] T.Kawakami, S.Takeda, W.Mori, K.Yamaguchi: "Theoretical studies of effective exchange interactions between nitro oxides viahydrogen atoms." Chem.Phys.Lett.261. 129-137 (1996)

    • 説明
      「研究成果報告書概要(和文)」より
  • [文献書誌] N.Ueyama, Y.Yamada, J.Takeda, T.-A.Okamura, W.Mori, A.Nakamura: "Magneticproperties of intramolecularly hydrogen-bonded car boxylatecopper(II)dimer complexes." J.Chem.Soc.,Chem.Commun.1996. 1377-1378 (1996)

    • 説明
      「研究成果報告書概要(和文)」より
  • [文献書誌] S.Takeda, F.Kondoh, N.Nakayama, K.Yamaguchi: "Proton Tunneling and Local Symmetry of the Hydrogen Bond in Rb_3H(SO_4)_2" Physica B. 226. 157-160 (1996)

    • 説明
      「研究成果報告書概要(和文)」より
  • [文献書誌] S.Yamada, M.Nakano, I.Shigemoto, K.Yamaguchi: "Static second hyperpolarizabilitiesg of nitroxideradical and formaldehyde : evaluation of spatial contributions to g by a hyperpolarizability density analysis." Chem.Phys.Lett.254. 158-164 (1996)

    • 説明
      「研究成果報告書概要(和文)」より
  • [文献書誌] I.Shigemoto, M.Nakano, S.Yamada, S.Kiribayashi, K.Yamaguchi: "Theoretical studies on nonlinear optical properties of organometallic conjugated systems I.Static third-order hyperpolarizabilities of first-transition-metal and metalmethylene cations." Mol.Cryst.Liq.Cryst. 286. 159-164 (1996)

    • 説明
      「研究成果報告書概要(和文)」より
  • [文献書誌] K.Ueda, S.Takamizawa, W.Mori, K.Yamaguchi: "Magnetic Properties of Basis Copper(II) Formates" Mol.Cryst.Liq.Cryst. 286. 17-22 (1996)

    • 説明
      「研究成果報告書概要(和文)」より
  • [文献書誌] H.Nagao, H.Kawabe, T.Kawakami, M.Okumura, W.Mori, K.Nishikawa, K.Yamaguchi: "Calculation of magnetization by path integral method I." Mol.Cryst.Liq.Cryst.286. 171-176 (1996)

    • 説明
      「研究成果報告書概要(和文)」より
  • [文献書誌] S.Takeda, H.Kataoka, S.Ikeda, K.Yamaguchi: "Rotational Tunneling of Methyl Groups of Sc(CH_3COO)_3 and Sc(CD_3COO)_3." Physica B. 226. 174-177 (1996)

    • 説明
      「研究成果報告書概要(和文)」より
  • [文献書誌] T.Kawakami, H.Nagao, K.Ueda, W.Mori, K.Yamaguchi: "Calculation of magnetization by path integral method II." Mol.Cryst.Liq.Cryst.286. 177-184 (1996)

    • 説明
      「研究成果報告書概要(和文)」より
  • [文献書誌] T.Nogami, T.Ishida, M.Yasui, F.Iwasaki, N.Takeda, M.Ishikawa, T.Kawakami, K.Yamaguchi: "Proposed Mechanism of Ferromagnetic Interaction of Organic Ferromagnets 4-(Arylmethyleneamino)-2,2,6,6-tetramethylpiperidin-1-oxylsand Related Compounds." Bull.Chem.Soc.Jpn.69. 1841-1848 (1996)

    • 説明
      「研究成果報告書概要(和文)」より
  • [文献書誌] M.Fujiwara, M.Nishino, S.Takamizawa, W.Mori, K.Yamaguchi: "Abinitio MO calculations of superexchange integrals for transition-metal fluorides : MFM3+(M=Cu(ii),Ni(ii) and Mn(ii)).Active control of the magnetic states." Mol.Cryst.Liq.Cryst.286. 185-192 (1996)

    • 説明
      「研究成果報告書概要(和文)」より
  • [文献書誌] G.Maruta, D.Yamaki, W.Mori, K.Yamaguchi, H.Nishide: "Theoretical Study of Effective Exchange Integrals for Ferromagentic Phenylenevinylene Polymers with Nitroxides.Possibilities of Organic Ferro- or Ferri-magnetic Solids." Mol.Cryst.Liq.Cryst.279. 19-28 (1996)

    • 説明
      「研究成果報告書概要(和文)」より
  • [文献書誌] M.Nishino, M.Tanaka, S.Takeda, K.Mashima, W.Mori, K.Tani, A.Nakamura, K.Yamaguchi.: "Theoretical studies of direct exchange couplings between transition metalionsI.naked binuclear chromium(II) and molybdenum(II) systems." Mol.Cryst.Liq.Cryst.286. 193-200 (1996)

    • 説明
      「研究成果報告書概要(和文)」より
  • [文献書誌] N.Ueyama, K.Taniuchi T.-A.Okamura, A.Nakamura, H.Maeda, S.Emura: "Effect of the NH・・・S Hydrogen Bond on the Nature of Hg-S Bonding in Bis〔2-(acylamino)-benzenethiolato〕mercury(II) and Bis〔2,6-bis(acylamino)benzenethiolato〕mercury(II) Complexes." Inorg.Chem.35. 1945-1951 (1996)

    • 説明
      「研究成果報告書概要(和文)」より
  • [文献書誌] M.Nishino, M.Tanaka, S.Takeda, K.Mashima, W.Mori, K.Tani, A.Nakamura, K.Yamaguchi: "Theoretical Studies of Direct Exchange Couplings between Transition Metal Ions-II.Tetranuclear Transition Metal Systems." Mol.Cryst.Liq.Cryse.286. 201-210 (1996)

    • 説明
      「研究成果報告書概要(和文)」より
  • [文献書誌] T.Daniel, H.Nagao, H.Nakajima, K., A.Nakamura: "Seven-coordinated 2,2' : 6'2"-Terpyridinemolybdenum(II) Complexes Synthesis Structure and Reactivity of〔Mo(CO)(C_7H_8)(4,4',4"-R_3terpy)X〕X'(R=H or tBu)" J.Organomet.Chem.509. 225-234 (1996)

    • 説明
      「研究成果報告書概要(和文)」より
  • [文献書誌] K.Mashima, Y.Tanaka, M.Kaidzu, A.Nakamura: "cis-iso-Specific Polymerization of Norbornenes by a Unique Combination of Cp' and 1,3-Butadiene Ligands on Tantalum : Crystal Structures of Cp'(η^4-C_4H_6)Ta(CH_2Ph)_2 and Cp'(η^4-C_4H_6)Ta(=CHPh)(PMe_3)." Organometallics. 15. 2431-2433 (1996)

    • 説明
      「研究成果報告書概要(和文)」より
  • [文献書誌] M.Nakano, S.Yamada, I.Shigemoto, K.Yamaguchi: "Dynamic (hyper)polarizability density analysis based on virtual excitation processes : Visuallization of dynamic electron fluctuatability of systems under time-dependent external electric fields." Chem.Phys.Lett.250. 247-254 (1996)

    • 説明
      「研究成果報告書概要(和文)」より
  • [文献書誌] Y.Yoshioka, S.Yamada, T.Kawakami, M, Nishino, K.Yamaguchi, I.Saito: "Ab Initio Molecular Orbital Studies of Singlet Oxygen Reactions of Olefins,Enol Ethers,and Enamines." Bull.Chem.Soc.Jpn.69. 2638-2699 (1996)

    • 説明
      「研究成果報告書概要(和文)」より
  • [文献書誌] Y.Yoshioka, S.Yamanaka, S.Yamada, T.Kawakami, M.Nishino, K.Yamaguchi, A.Nishinaga: "Theoretical and Experimental Studies of a Charge-Transfer Mechanism for Biomimetic Oxygenations of Phenol and Indol Derivatives." Bull.Chem.Soc.Jpn.69. 2701-2722 (1996)

    • 説明
      「研究成果報告書概要(和文)」より
  • [文献書誌] T.Kawakami, A.oda, W.Mori, K.Yamaguchi, K.Inoue, H.Iwamura: "Theoretical Studies of the Ferromagnetic Intermolecular Interaction of p-Carboxylate Phenyl Nitronyl Nitroxide." Mol.Cryst.Liq.Cryst.279. 29-38 (1996)

    • 説明
      「研究成果報告書概要(和文)」より
  • [文献書誌] M.Nakano, Y.Matsuzaki, H.Nagao, S.Yamada, I.Shigemoto, K.Yamaguchi: "Damping wave packets approach : a caluculation method of intensity-dependent nonlinear optical susceptibilities including effects of nuclear motions at finite temperatures." Chem.Phys.Lett.258. 307-315 (1996)

    • 説明
      「研究成果報告書概要(和文)」より
  • [文献書誌] H.Oku, N.Ueyama, A.Nakamura: "A Comparison between the Structures of Tungstopterin Cofactor in Tungsten Oxidoreductase and a Model Complex,cis-Dioxobis(2,3-naphthalenedithiolate)tungsten(VI) in Their O-Atom Transfer Reaction." Chem.Lett.1996. 31-32 (1996)

    • 説明
      「研究成果報告書概要(和文)」より
  • [文献書誌] H.Oku, N.Ueyama, A.Nakamura: "Stabilization of Oxo-Metal Bonding by the π-Conjugated System in Dithiolate Ligands : cis-Dioxotungsten(VI) Bis(naphthalenedithiolato) and the Related Complexes as Models for Tungsten Oxidoreductases" Bull.Chem.Soc.Jpn.69. 3139-3150 (1996)

    • 説明
      「研究成果報告書概要(和文)」より
  • [文献書誌] Y.Yoshioka, D.Yamaki, G.Maruta, T.Tsunesada, K.Takada, T.Noro, K.Yamaguchi: "MO-Theoretical Description of Electronic Structures of Tricentric Bis-desmiphiles in the Ground and Excited States." Bull.Chem.Soc.Jpn. 69. 3395-3415 (1996)

    • 説明
      「研究成果報告書概要(和文)」より
  • [文献書誌] T.Ueno, N.Ueyama, A.Nakamura: "Redox Behavior of 4Fe-4S Ferredoxin Model Arenethiolate Complexes Involving Specific NHS Hydrogen Bonds Assisted by a Neighbouring Phenyl Group." J.Chem.Soc.,Dalton Trans.1996. 3859-3863 (1996)

    • 説明
      「研究成果報告書概要(和文)」より
  • [文献書誌] M.Nakano, S.Yamada, I.Shigemoto, K.Yamaguchi: "Theoretical study on the geometry dependence of the second hyperpolarizability of allyl cation based on a numerical Liouvile three-type analysis." Chem.Phys.Lett.251. 391-396 (1996)

    • 説明
      「研究成果報告書概要(和文)」より
  • [文献書誌] H.Nakano, A.Nakamura, K.Mashima: "Linear Trinuclear Pt・・・Mo-Mo Complexes [Mo_2PtX_2(pyphos)_2(O_2CR)_2]_2(X=Cl,Br,I,R=CH_3,C(CH_3)_3,pyphos=6-diphenylphosphino-2-pyridonate) with an Axial Interaction between the Quadruply Bonded Mo_2 Moiety and the Platinum Atom." Inorg.Chem.35. 4007-4012 (1996)

    • 説明
      「研究成果報告書概要(和文)」より
  • [文献書誌] K.Mashima, M.Tanaka, K.Tani, H.Nakano, A.Nakamura: "Dinuclear Pd(I)-Pd(I) and Pt(II)・・・Pt(II) Complexes Supported by Tridentate Pyphos Ligands(pyphos=6-(diphenylphosphino)-2-pyridonate)." Inorg.Chem.35. 5244-5248 (1996)

    • 説明
      「研究成果報告書概要(和文)」より
  • [文献書誌] N.Ueyama, H.Oku, M.Kondo, T.-A.Okamura, N.Yoshinaga, A.Nakamura: "Trans Influence of Oxo and Dithiolene Coordination in Oxidized Models of Molybdenum Oxidoredactase : Synthesis,Structures,and Properties of Q_2[MoVIO_2(1,2-benzenedithiolato)_2](Q=NEt_4,PPh_4) and Related Complexes." Inorg.Chem.35. 643-650 (1996)

    • 説明
      「研究成果報告書概要(和文)」より
  • [文献書誌] N.Ueyama, Y.Yamada, T.-A.Okamura, S.Kimura, A.Nakamura: "Srtucture and Properties of [Fe_4S_4{2,6-bis(acylamino)-benzenethiolato-S}_4]^<2-> and [Fe_2S_2{2,6-bis(acylamino)-benzenethiolato-S}_4]^<2-> : Protection of the Fe-S Bond by Double NH・・・S Hydrogen Bonds." Inorg.Chem.35. 6473-6484 (1996)

    • 説明
      「研究成果報告書概要(和文)」より
  • [文献書誌] M.Nakano, S.Kiribayashi, S.Yamada, I.Shigemoto, K.Yamaguchi: "Theoretical study of the second hyperpolarizabilities of three charged states of pentalene.A consideration of the structure-property correlation for the sensitive second hyperpolarizability." Chem.Phys.Lett.262. 66-73 (1996)

    • 説明
      「研究成果報告書概要(和文)」より
  • [文献書誌] Y.Nakayama, H.Saito, and A.Nakamura: "Selective Synthesis of Tungsten(VI) Mono(catecholato) Complexes Using 1,2-Bis(trimethylsiloxy)benzenes : Molecular Structure of WCl_4(O_2C_6H_4)." Chem.Lett.1996. 691-692 (1996)

    • 説明
      「研究成果報告書概要(和文)」より
  • [文献書誌] M.Nishino, S.Yamanaka, Y.Yoshioka, K.Yamaguchi: "Theoretical Approaches to Direct Exchange Coupling between Divalent Chromium Ions in Naked Dimer,Tetramer and Clusters" J.Phys.Chem.101. 705-712 (1996)

    • 説明
      「研究成果報告書概要(和文)」より
  • [文献書誌] H.Nagao, M.Nakano, S.Yamanaka, Y.Shigeta, S.Yamada, D.Yamaki, I.Shigemoto, S.Kiribayashi, K.Yamaguchi: "Many-Electron-Wavepackets Method." Int.J.Quantum Chem. 60. 79-89 (1996)

    • 説明
      「研究成果報告書概要(和文)」より
  • [文献書誌] H.Takahashi, T.Kasai, K.Yamaguchi: "Wave Packet Simulation on the Cage Effect in the Full Scarrering : CF3H+Ar(3P)-CF3^*+H+Ar" Chem.Lett.1996. 793-794 (1996)

    • 説明
      「研究成果報告書概要(和文)」より
  • [文献書誌] Y.Nakayama, T.Shibahara, H.Fukumoto, A.Nakamura, K.Mashima: "Syndiospecific Polymerization of Methyl Methacrylate Catalyzed by Lanthanoid Thiolate Complexes Bearing Hexamethylphosphoric Triamide Ligand." Macromolecules. 29. 8014-8016 (1996)

    • 説明
      「研究成果報告書概要(和文)」より
  • [文献書誌] K.Hatanaka, Y.Morita, T.Ohba, K.Yamaguchi, T.Takui, M.Kinoshita, K.Nakasuji: "Detection of New Neutral Radicals : 2-Phenyl-and 2-p-Methoxyphenyl-3-oxophenalenoxyl Radicals." Tetrahedron Lett. 37. 873-876 (1996)

    • 説明
      「研究成果報告書概要(和文)」より
  • [文献書誌] K.Mashima, H.Nakano, A.Nakamura: "Reductive Formation of Straight Linear Metal-Metal Bonded Tetranuclear Complexes X-M-Mo-Mo-M-X from X_2M・・・Mo-Mo・・・MX_2 Supported by Four Tridentate 6-Diphenylphosphino-2-pyridonate Ligands (M=Pd,Pt ; X=Cl,Br,I)." J.Am.Chem.Soc.118. 9083-9095 (1996)

    • 説明
      「研究成果報告書概要(和文)」より
  • [文献書誌] K.Mashima, Y.Nakayama, T.Shibahara, H.Fukumoto, A.Nakamura,: "Synthesis of Arenethiolate Complexes of Divalent and Trivalent Lanthanides from Metallic Lanthanides and Diaryl Disulfides : Crystal Structures of [{Yb(hmpa)_3}_2(μ-SPh)_3][SPh] and Ln(SPh)_3(hmpa)_3(Ln=Sm,Yb ; hmpa=hexamethylphosphoric triamide)" Inorg.Chem.35. 93-99 (1996)

    • 説明
      「研究成果報告書概要(和文)」より
  • [文献書誌] M.Nakano, H.Nagao, K.Yamaguchi: "Many-electron Hyperpolarizability Density Analysis : Application to Dissociation Process of One-Dimensional H2" Phys.Rev.A. 55. 1503-1513 (1997)

    • 説明
      「研究成果報告書概要(和文)」より
  • [文献書誌] S.Takeda, H.Fukumoto, K.Mashima, G.Maruta, K.Yamaguchi, A.Nakamura: "Thermochromism and Dynamics of Organometallis Conjugated Systems ^+Zirconocene Complex of 1,4-Diphenyl-1,3-butadiene" J.Phys.Chem.101. 278-284 (1997)

    • 説明
      「研究成果報告書概要(和文)」より
  • [文献書誌] H.Takahashi, T.Kasai, K.Yamaguchi: "Wavepacket Dynamics in the Full Reaction of CF3H+Ar(3P)-CF3^*+H+Ar : Quantum Interference for the H-end Orientation" Chem.Phys.Lett.264. 44-50 (1997)

    • 説明
      「研究成果報告書概要(和文)」より
  • [文献書誌] H.Nagao, K.Kawabe, K.Kodama, Y.Shigeta, K.Nishikawa, M.Nakano, K.Yamaguchi: "Nonadiabatic Treatment of Molecular System by the Wavepacket Method" Int.J.Quant.Chem.60. 49-58 (1997)

    • 説明
      「研究成果報告書概要(和文)」より
  • [文献書誌] T.Kawakami, A.Oda, S.Takeda, W.Mori, T.Ishida, M.Yasui, F.Iwasaki, T.Nogami, K.Yamaguchi: "Magnetic Interaction viab-Hydrogen Atomsin TEMPO Derivatives." Mol.Cryst.Liq.Cryst.(in press). (1997)

    • 説明
      「研究成果報告書概要(和文)」より
  • [文献書誌] A.Nakamura and N.Ueyama: "Iron-Sulfur Models of Protein Active Sites in Encyclopedia of Inorganio Chemistry" R.B.King,John Wiley, 14 (1994)

    • 説明
      「研究成果報告書概要(和文)」より
  • [文献書誌] 中村 晃: "有機金属化学辞典 遷移金属 5.ジルコニウム、ハフニウム" 朝倉書店, 54 (1995)

    • 説明
      「研究成果報告書概要(和文)」より
  • [文献書誌] N.Ueyama, T.Okamura, A.Nakamura: ""New Macromolecular Architecture and Functions" Chemical Functions of NH・・・S Hydrogen Bonds in Model Complexes of Iron-Sulfur Metalloproteins." Springer-Velag, 11 (1996)

    • 説明
      「研究成果報告書概要(和文)」より
  • [文献書誌] M.Nakano, K.Yamaguchi: "Theoretical Studies for Third-order Hyperpolarizabilities of Alternant and Condenced-ring Conjugated Systems I." Mol.Cryst.Liq.Cryst.255. 139-148 (1994)

    • 説明
      「研究成果報告書概要(欧文)」より
  • [文献書誌] K.Mashima, H.Sugiyama, A.Nakamura: "Diene Complex of Lanthanum : The Crystal Structure of a Diene-bridged Dilanthanum Complex, [LaI_2 (thf)_3 (mu-eta^4 : eta^4 : -PhCH=CHCH=CHPh) LaI_2 (thf)_3]." J.Chem.Soc., Chem.Commun.1994. 1581-1582 (1994)

    • 説明
      「研究成果報告書概要(欧文)」より
  • [文献書誌] K.Mashima, S.Fujikawa, H.Urata, E.Tanaka, A.Nakamura: "Polythylene with Extremely Narrow Polydispersity Obtained from the New Catalyst Systems Nb (eta^5-C_5Me_5) (eta^4-diene) Cl_2-MAO and Nb (eta^5-C_5Me_5) (eta^4-diene)_2-MAO." J.Chem Soc., Chem.Commun.1994. 1623-1624 (1994)

    • 説明
      「研究成果報告書概要(欧文)」より
  • [文献書誌] N.Ueyama, M.Kondo, H.Oku, A.Nakamura: "Structure and Properties of (NEt_4)_2 [MoIVO (alpha, 2-toluenedithiolato)_2]." Bull.Chem.Soc.Jpn.67. 1840-1847 (1994)

    • 説明
      「研究成果報告書概要(欧文)」より
  • [文献書誌] S.Yamanaka, T.Kawamura, T.Noro K.Yamaguchi: "Heisenberg Model for Radical Reactions. Part 3. Direct Exchange Coupling between Transition Metal Ions and Triplet Methylene." J.Mol.Struct. (Theochem). 310. 185-196 (1995)

    • 説明
      「研究成果報告書概要(欧文)」より
  • [文献書誌] S.Yamanaka, M.Okumura, M.Nakano, K.Yamaguchi: "EHF Theory of Chemical Reactions. Part 4. UNO CASSCF,UNO CASPT2 and R (U) HF Coupled-cluster (CC) Wavefunctions." J.Mol.Struct. (Theochem). 310. 205-218 (1994)

    • 説明
      「研究成果報告書概要(欧文)」より
  • [文献書誌] H.Oku, N.Ueyama, M.Kondo, A.Nakamura: "Oxygen Atom Transfer Systems in Which the (mu-Oxo) dimolybdenum (V) Complex Formation Does Not Occur : Syntheses, Structures, and Reactivities of Monooxomolybdenum (IV) Benzenedithiolato Complexes as Models of Molybdenum Oxidoreductases." Inorg.Chem.33. 209-216 (1994)

    • 説明
      「研究成果報告書概要(欧文)」より
  • [文献書誌] S.Yamanaka, T.Kawakami, H.Nagao, K.Yamaguchi: "Effective Exchange Integrals for Open-shell Species by Density Functional Method." Chem.Phys.Lett.231. 25-33 (1994)

    • 説明
      「研究成果報告書概要(欧文)」より
  • [文献書誌] K.Mashima, Y.Nakayama, H.Fukumoto, N.Kanehisa, Y.Kai, A.Nakamura: "Formation of Lanthanoid (II) and Lanthanoid (III) Thiolate Complexes Derived from Meatls and Organic Disulfides : Crystal Structures of [{Ln (SAr) (mu-SAr) (thf)_3}_2] (Ln = Sm, Eu), [Sm (SAr)_3 (py)_2 (thf)] and [Yb (SAr)_3 (py)_3] (Ar = 2,4,6-triisopropylphenyl ; py = Pyridine)." J.Chem.Soc., Chem.Commun.1994. 2523-2524 (1994)

    • 説明
      「研究成果報告書概要(欧文)」より
  • [文献書誌] M.Nakano, K.Yamaguchi, T.Fueno: "Coupled Hartree-Fock Calculations of the Third-order Hyperpolarizabilities for Mixed and Segregated Charge-transfer Clusters." Nonlinear Optics. 6. 289-296 (1994)

    • 説明
      「研究成果報告書概要(欧文)」より
  • [文献書誌] M.Nakano, K.Yamaguchi: "Numerical Liouville Approach : A Calculation Method for Nonlinear Optical Susceptibilities of N-state Systems." Phys.Rev.50. 2989-3004 (1994)

    • 説明
      「研究成果報告書概要(欧文)」より
  • [文献書誌] K.Mashima, A.Nakamura: "Living Polymerization of Ethylene by Organometallic Complexes" Shokubai. 1994. 572-579 (1994)

    • 説明
      「研究成果報告書概要(欧文)」より
  • [文献書誌] H.Oku, N.Ueyama, A.Nakamura, Y.Kai, N.Kanehisa: "The Stablization of Dioxomolybdenum (VI) Dithiolene Complex by the Electron Withdrawing Substituent on the Dithiolene Ligand : Comparison of Reactivities of Monooxomolybdenum (IV) Complex with R_2S_2C_2 (R = -CN and -COOMe) Ligands as Models of Molybdenum Oxidoreductases." Chem.Lett.1994. 607-610 (1994)

    • 説明
      「研究成果報告書概要(欧文)」より
  • [文献書誌] K.Mashima, H.Sugiyama, N.Kanehisa, Y.Kai, H.Yasuda, A.Nakamura: "Diene Complexes of Calcium and Strontium : First Crystal Structures of Calcium-and Strontium-Diene Complexes, M (2,3-dimethyl-1,4-diphenyl-1,3-butadiene) (THF)_4 (M=Ca and Sr)." J.Am.Chem.Soc.116. 6977-6978 (1994)

    • 説明
      「研究成果報告書概要(欧文)」より
  • [文献書誌] T.Tsunekawa, K.Yamaguchi: "Theoretical Studies on Hydrogen Bonding Interactions and Electronic Polarizations and Clusters of 3,9-Dinitro-5a, -6,11a, 12-tetrahydro [1,4] benzoxazino [3,2-b] [1,4] benzoxazine." J.Phys.Chem.98. 785-791 (1994)

    • 説明
      「研究成果報告書概要(欧文)」より
  • [文献書誌] K.Mashima, Y.Nakayama, A.Nakamura, N.Kanehisa, Y.Kai, H.Takava: "A New Convenient Preparation of Monocyclooctatetraenyl-lanthanide Complexes from Metallic Lanthanides and Oxidants." J.Organomet.Chem.473. 85-91 (1994)

    • 説明
      「研究成果報告書概要(欧文)」より
  • [文献書誌] M.Fujiwara, S.Takamizawa, W.Mori, K.Yamaguchi: "Molecular Design and Synthsis of Ferro-and Ferri Magnetic Inorganic Polymers and Complexes with Tetrathiolate Ligands." Mol.Cyst.Liq.Cryst.279. 1-8 (1995)

    • 説明
      「研究成果報告書概要(欧文)」より
  • [文献書誌] T.Daniel, H.Nagao, K.Tanaka, A.Nakamura: "Norbornadiene (bipyridyl) molybdenum (II) Complexes Synthesis, Structure nd Reactivity of [Mo (CO) (C_7H_8) (C_<10>H_6R_2N_2) X_2] (X=I,Br)." Chem.Ber.128. 1007-1013 (1995)

    • 説明
      「研究成果報告書概要(欧文)」より
  • [文献書誌] T.Daniel, N.Suzuki, K.Tanaka, A.Nakamura: "Fluxional Behavior of Tert-butyl-substituted 2,2' : 6"2"-Terpyridylmolybdenum (O) and 2,2'-Bipyridylmolybdenum (II) Complexes : Enhanced Solubility and Ease in NMR Study Caused by the Tert-butyl Group." J.Organomet.Chem.505. 109-117 (1995)

    • 説明
      「研究成果報告書概要(欧文)」より
  • [文献書誌] W.Mori, K.Yamaguchi: "Spin Glass Behavior of Synthetic Atacamite Cu_2Cl (OH)_3." Mol.Cryst.Liq.Cryst.274. 113-118 (1995)

    • 説明
      「研究成果報告書概要(欧文)」より
  • [文献書誌] T.Kawakami, S.Yamanaka, H.Nagao, W.Mori, M.Kamachi, K.Yamaguchi: "Theoretical approaches to molecular magnetism II : No-overlap and orientation principles for ferromagnetic interactions." Mol.Cryst.Liq.Cryst.272. 117 (1995)

    • 説明
      「研究成果報告書概要(欧文)」より
  • [文献書誌] S.Takeda, T.Inabe, T.Mitani, Y.Maruyanma, K.Yamaguchi: "ESR Study on the Charge Transfer Complexes of N-Salicylideneanilines containing NHO Hydrogen bond as a Dynamic Function." Synt.Metals. 70. 1211-1212 (1995)

    • 説明
      「研究成果報告書概要(欧文)」より
  • [文献書誌] S.Takeda, T.Inabe, T.Mitani, Y.Maruyanma, K.Yamaguchi: "ESR Study on the Charge Transfer Complexes of N-Salicylideneanilines containing NHO Hydrogen bond as a Dynamic Function." Synt.Metals. 70. 1211-1212 (1995)

    • 説明
      「研究成果報告書概要(欧文)」より
  • [文献書誌] A.Nakamura: "Organometallicp-Conjugated Systems." Bull.Chem.Soc.Jpn.68. 1515-1521 (1995)

    • 説明
      「研究成果報告書概要(欧文)」より
  • [文献書誌] M.Nakano, S.Yamada, K.Yamaguchi: "Theoretical Studies on Hyperpolarizabilitiues of Nitroxide Species I." Synt.Metals. 71. 1691-1692 (1995)

    • 説明
      「研究成果報告書概要(欧文)」より
  • [文献書誌] Y.Matuzaki, M.Nakano, K.Yamaguchi, K.Tanaka, T.Yamabe: "Second hyperpolarizabilies of p-conjugated sillicon-ringpolymers." Synt.Metals. 71. 1737-1738 (1995)

    • 説明
      「研究成果報告書概要(欧文)」より
  • [文献書誌] W.-Y.Sun, T.Ueno, N.Ueyama, A.Nakamura: "^<19>FNMR Investigations of Cobalt (II) Complexes with Cysteine-Containing Peptide Ligands." Magn.Reson.Chem.33. 174-177 (1995)

    • 説明
      「研究成果報告書概要(欧文)」より
  • [文献書誌] M.Fujiwara, W.Mori, K.Yamaguchi: "Iron-schiffBase Magnetic Polymers. Synthesis and Characterization." Mol.Cryst.Liq.Cryst.274. 175-178 (1995)

    • 説明
      「研究成果報告書概要(欧文)」より
  • [文献書誌] K.Mashima, Y.Tanaka, A.Nakamura: "Synthesis, Characterization, and Reaction of Ethylene Complexes bearing Ta (eta^5-C_5R_5) (eta^4-buta -1,3-diene) Fragments (R=H,Me)." J.Organomet.Chem.502. 19-23 (1995)

    • 説明
      「研究成果報告書概要(欧文)」より
  • [文献書誌] S.Yamanaka, T.Kawakami, H.Nagao, K.Yamaguchi: "Theoretical studies of spin populations on nitronylnitroxide, phenyl nitronylnitroxide and p-NPNN." Mol.Cryst.Liq.Cryst.271. 19 (1995)

    • 説明
      「研究成果報告書概要(欧文)」より
  • [文献書誌] M.Kitazawa, M.Takahashi, T.Wada, H.Sasabe, M.Nakano, K.Yamaguchi: "Theoretical Evaluation of Hyperpolarizability of L-2-pyrrolidone-5-carboxylic Acid (L-PCA)." Bull.Chem.Soc.Jpn.68. 2215-2224 (1995)

    • 説明
      「研究成果報告書概要(欧文)」より
  • [文献書誌] S.Yamanaka, T.Kawakami, M.Okumura, K.Yamaguchi: "CASSCF AND CASPT2 calculations of hole-doped polycarbenes. Possibilities of organic ferromagnetic conductors and metals." Chem.Phys.Lett.233. 257 (1995)

    • 説明
      「研究成果報告書概要(欧文)」より
  • [文献書誌] A.Nakamura, K.Mashima: "Recent Progress in the Chemistry of 1,3-Diene Complexes of Niobium and Tantalum." J.Organomet.Chem.500. 261-267 (1995)

    • 説明
      「研究成果報告書概要(欧文)」より
  • [文献書誌] K.Mashima, T.Shibahara, Y.Nakayama, A.Nakamura: "Synthesis and Characterization of Cationic Pyridine-2-thiolate Complexes of Lanthanooid (III) : Crystal Structures of Pentagonal Bipyramidal [Ln (SC_5H_4N)_2 (hmpa)_3] I (Ln = Sm, Yb ; hmpa = hexamethylphosphoric triamide)." J.Organomet.Chem.501. 263-269 (1995)

    • 説明
      「研究成果報告書概要(欧文)」より
  • [文献書誌] K.Mashima, S.Fujikawa, Y.Tanaka, Y.Urata, T.Oshiki, E.Tanaka, A.Nakamura: "Living Polymerization of Ethylene Catalyzed by Diene Complexes of Niobium and Tantalum, M (eta^6-C_5Me_5) (eta^4-diene) X_2 and M (eta^5-C_5Me_5) (eta^4-diene)_2・ (M=Nb and Ta) in the Presence of Methylaluminoxane." Organometallics. 14. 2633-3640 (1995)

    • 説明
      「研究成果報告書概要(欧文)」より
  • [文献書誌] S.Yamanaka, T.Kawakami, S.Yamada, H.Nagao, M.Nakano, K.Yamaguchi: "Theoretical studies of spin density populations on nitroxide and nitronylnitroxidderivatives." Chem.Phys.Lett.240. 268-277 (1995)

    • 説明
      「研究成果報告書概要(欧文)」より
  • [文献書誌] R.Hahn, A.Nakamura, T.Tanaka, Y.Nakayama: "Synthesis and Molecular Structure of a Pentacoordinated Nickel (II) Complex with a Mixed S_2N_3 Coordination Sphere." Chem.Phys.Lett.240. 268-277 (1995)

    • 説明
      「研究成果報告書概要(欧文)」より
  • [文献書誌] M.Nakano, K.Yaaguchi, Y.Matuzaki, K.Tanaka, T.Yamabe: "Numerical Liouville Approach : Formulation of Third-order Nonlinear Optical Susceptibilities." J.Chem.Phys.102. 2986-2995 (1995)

    • 説明
      「研究成果報告書概要(欧文)」より
  • [文献書誌] M.Nakano, K.Yaaguchi, Y.Matuzaki, K.Tanaka, T.Yamabe: "Numerical Liouville Approach : Three-type Analysis of Virtual Excitation processes of Third-order Nonlinear Optical Spectrain Third-harmonic Generation." J.Chem.Phys.102. 2996-3004 (1995)

    • 説明
      「研究成果報告書概要(欧文)」より
  • [文献書誌] H.Zaima, N.Ueyama, H.Adachi, A.Nakamura: "^1H-, ^<13>C-, and ^<113>Cd-NMR Study of the Cd (II) Complex of a Blocked Peptide, Z-Cys-Ala-Pro-His-OMe, in Organic Solvents." Biopolymers.35. 319-329 (1995)

    • 説明
      「研究成果報告書概要(欧文)」より
  • [文献書誌] M.Nakano, K.Yamaguchi: "Numerical Liouville Approach : Intensity Dependent Transient Linear and Nonlinear Optical Susceptibilities." Chem.Phys.Lett.234. 323-323 (1995)

    • 説明
      「研究成果報告書概要(欧文)」より
  • [文献書誌] H.Oku, N.Ueyama, A.Nakamura: "Thiolato-Activated Oxo-Metal Bond Featuresin Molybdenum and Tungsten Oxidoreductase Models As Revealed by Raman Spectroscopy." Inorg.Chem.34. 3667-3676 (1995)

    • 説明
      「研究成果報告書概要(欧文)」より
  • [文献書誌] S.Nagatomo, S.Takeda, K.Yamaguchi, M.Iwata, Y.Ishibashi: "New Cation Duffusing Phase of (CH_3NH_3)_5Bi_2Cl_<11>." J.Phys.Soc.Jpn.64. 391-394 (1995)

    • 説明
      「研究成果報告書概要(欧文)」より
  • [文献書誌] M.Nakano, K.Yamaguchi, Y.Matuzaki, K.Tanaka, T.Yamabe: "Numerical Liouville Approach : Third-order Nonlinear Optical Susceptibilities in THG,EFISH and DFWM." Chem.Phys.Lett.233. 411-419 (1995)

    • 説明
      「研究成果報告書概要(欧文)」より
  • [文献書誌] T.Kawakami, S.Yamanaka, W.Mori, K.Yamaguchi, A.Kiajiwara, M.Kamachi: "No-overlap and orientation principle for ferromagnetic interactions between nitroxide groups." Chem.Phys.Lett.235. 414 (1995)

    • 説明
      「研究成果報告書概要(欧文)」より
  • [文献書誌] M.Nakano, I.Shigemoto, S.Yamada, K.Yamaguchi: "Size-consistent Approach and Density Analysis of Hyperpolarizability : Second Hyperpolarizabilities of Polymeric Systems with and with out Defects." J.Chem.Phys.103. 4175-4191 (1995)

    • 説明
      「研究成果報告書概要(欧文)」より
  • [文献書誌] N.Ueyama, T.-A.Okamura, Y.Yamada, A.Nakamura: "Crystal and Solution Structure of Novel Bulky Bis [2,6-di (acylamino) phenyl] Disulfides. Absence of Covalent NH・・・S Hydrogen Bond between Amide NH and Neighboring Disulfide in Bis [2,6-di (pivaloylamino) phenyl] Disulfide." J.Org.Chem.60. 4893-4899 (1995)

    • 説明
      「研究成果報告書概要(欧文)」より
  • [文献書誌] K.Mashima, Y.Tanaka, A.Nakamura: "Synthesis, Characterization, and Reactions of a Mononuclear Tantalum-benzyne Complex, Ta(eta^5-C_5Me_5) (eta^4-C_4H_6) (eta^2-C_6H_4)." Organometallics. 14. 5642-5651 (1995)

    • 説明
      「研究成果報告書概要(欧文)」より
  • [文献書誌] H.Oku, N.Ueyama, A.Nakamura: "Electronic and Steric Effect of Bulky Triphenyl Substituentin the Monooxobenzenedithiolatomolybdenum (V) Complexand the Tungsten Analog as Models of Molybdenum and Tungsten Oxidoreductase." Chem.Lett.621-622 (1995)

    • 説明
      「研究成果報告書概要(欧文)」より
  • [文献書誌] D.Yamaki, S.Yamada, G.Maruta, T.Kawakami, W.Mori.K.Yamaguchi: "Theoretical Calculation of Effective Exchange Integrals for One-and Two-Dimensional Poly (phynylenemethylene) Systems. Possibilities of Organic Ferro-and Ferri -Magnetic Solids." Mol.Cryst.Liq.Cryst.279. 9-18 (1995)

    • 説明
      「研究成果報告書概要(欧文)」より
  • [文献書誌] H.Oku, N.Ueyama, A.Nakamura: "Bonzoin Oxidation at Extreme Temperature by Bis (1,2-benzenedithiolato) dioxotungsteate (VI) Complex : A Model Study for Hyperthermostable Tungsten Oxidoreductases" Chem.Lett.1996. 1131-1132 (1996)

    • 説明
      「研究成果報告書概要(欧文)」より
  • [文献書誌] M.Kondo, H.Oku, N.Ueyama, A.Nakamura: "Synthesis and Properties of a Nitridomolybdenum (VI) Complex Having Benzenedithiolatd Ligands. Effect of the Thiolate on the Activation of the Nitrido Ligand." Bull.Chem.Soc.Jpn.69. 117-123 (1996)

    • 説明
      「研究成果報告書概要(欧文)」より
  • [文献書誌] Y.Matsuzaki, M.Nakano, K.Yamaguchi, K.Tanaka, T.Yamabe: "Third-order optical nonlinearlity in new p-conjugated polymers : polydiethynylsilane and polysilole." Chem.Phys.Lett.263. 119-125 (1996)

    • 説明
      「研究成果報告書概要(欧文)」より
  • [文献書誌] N.Ueyama, N.Nishikawa, Y.Yamada, T.-A.Okamura, A.Nakamura: "Cytochrome P-450Model (Porphinato) (thiolato) iron (III) Complexes with Single and Double NH・・・S Hydrogen Bonds at the Thiolate Site." J.Am.Chem.Soc.118. 12826-1282 (1996)

    • 説明
      「研究成果報告書概要(欧文)」より
  • [文献書誌] T.Kawakami, S.Takeda, W.Mori, K.Yamaguchi: "Theoretical studies of effective exchange interactions between nitroxidesviahydrogen atoms." Chem.Phys.Lett.261. 129-137 (1996)

    • 説明
      「研究成果報告書概要(欧文)」より
  • [文献書誌] N.Ueyama, Y.Yamada, J.Takeda, T.-A.Okamura, W.Mori, A.Nakamura: "Magnetic properties of intramolecularly hydrogen-bonded carboxylate copper (II) dimercomplexes." J.Chem.Soc., Chem.Commun.1996. 1377-1378 (1996)

    • 説明
      「研究成果報告書概要(欧文)」より
  • [文献書誌] S.Takeda, F.Kondoh, N.Nakayama, K.Yamaguchi: "Proton Tunneling and Local Symmetry of the Hydrogen Bond in Rb_3H (SO_4)_2" Physica B. 226. 157-160 (1996)

    • 説明
      「研究成果報告書概要(欧文)」より
  • [文献書誌] S.Yamada, M.Nakano, I.Shigemoto, K.Yamaguchi: "Static second hyperpolarizabilities g of nitroxide radical and formaldehyde : evaluation of spatial contributions to g by a hyperpolarizability density analysis." Cham.Phys.Lett.254. 158-164 (1996)

    • 説明
      「研究成果報告書概要(欧文)」より
  • [文献書誌] I.Shigemoto, M.Nakano, S.Yamada, S.Kiribayashi, K.Yamaguchi: "Theoretical studies on nonlinear optical properties of organometallic conjucated systems I.Static third-order hyperpolarizabilities of first-transition-metal and metalmethylenecations." Mol.Cryst.Liq.Cryst. 286. 159-164 (1996)

    • 説明
      「研究成果報告書概要(欧文)」より
  • [文献書誌] K.Ueda, S.Takamizawa, W.Mori, K.Yamaguchi: "Magnetic Properties of Basis Copper (II) Formates" Mol.Cryst.Liq.Cryst.286. 17-22 (1996)

    • 説明
      「研究成果報告書概要(欧文)」より
  • [文献書誌] H.Nagao, H.Kawabe, T.Kawakami, M.Okumura, W.Mori, K.Nishikawa, K.Yamaguchi: "Calculation of magnetization by path integral method I." Mol.Cryst.Liq.Cryst.286. 171-176 (1996)

    • 説明
      「研究成果報告書概要(欧文)」より
  • [文献書誌] S.Takeda, H.Kataoka, S.Ikeda, K.Ymaguchi: "Rotational Tunneling of Methyl Groups of Sc (CH_3COO)_3 and Sc (CD_3COO)_3." Physica B. 226. 174-177 (1996)

    • 説明
      「研究成果報告書概要(欧文)」より
  • [文献書誌] T.Kawakami, H.Nagao, K.Ueda, W.Mori, K.Yamaguchi: "Calculation of magnetization by path integral method II." Mol.Cryst.Liq.Cryst.286. 177-184 (1996)

    • 説明
      「研究成果報告書概要(欧文)」より
  • [文献書誌] T.Nogami, T.Ishida, M.Yasui, F.Iwasaki, N.Takeda, M.Ishikawa, T.Kawakami, K.Yamaguchi: "Proposed Mechanism of Ferromagnetic Interaction of Organic Ferromagnets 4- (Arylmethyleneamino) -2,2,6,6-tetramethylpiperidin-1-oxyls and Related Compouds." Bull.Chem.Soc.Jpn.69. 1841-1848 (1996)

    • 説明
      「研究成果報告書概要(欧文)」より
  • [文献書誌] M.Fujiwara, M.Nishino, S.Takamizawa, W.Mori, K.Yamaguchi: "Ab initio MO calculations of superexchange integrals for transition-metal fluorides : MFM3+ (M=Cu (ii), Ni (ii) and Mn (ii)). Active control of the magnetic states." Mol.Cryst.Liq.Cryst.286. 185-192 (1996)

    • 説明
      「研究成果報告書概要(欧文)」より
  • [文献書誌] G.Maruta, D.Yamaki, W.Mori, K.Yamaguchi, H.Nishide: "Theoretical Study of Effective Exchange Integrals for Ferromagentic Phenylenevinylene Polymers weth Nitroxides. Possibilities of Organic Ferro-or Ferri-magnetic Solids." Mol.Cryst.Liq.Cryst.279. 19-28 (1996)

    • 説明
      「研究成果報告書概要(欧文)」より
  • [文献書誌] M.Nishino, M.Tanaka, S.Takeda, K.Mashima, W.Mori, K.Tani, A.Nakamura, K.Yamaguchi: "Theoretical studies of direct exchange couplings between transition metal ions I.naked binuclear chromium (II) and molybdenum (II) systems." Mol.Cryst.Liq.Cryst.286. 193-200 (1996)

    • 説明
      「研究成果報告書概要(欧文)」より
  • [文献書誌] N.Ueyama, T.Taniuchi T.-A.Okamura, A.Nakamura, H.Maeda, S.Emura: "Effect of the NH・・・S Hydrogen Bond on the Nature of Hg-S Bonding in Bis [2- (acylamino) -benzenethiolato] mercury (II) and Bis [2,6-bis (acylamino) benzenethiolato] mercury (II) Complexes." Inorg.Chem.35. 1945-1951 (1996)

    • 説明
      「研究成果報告書概要(欧文)」より
  • [文献書誌] M.Nishino, M.Tanaka, S.Takeda, K.Mashima, W.Mori, K.Tani, A.Nakamura, K.Yamaguchi: "Theoretical Studies sof Direct Exchange Couplings between Transition Metal Ions II.Tetranuclear Transition Metal Systems." Mol.Cryst.Liq.Cryst.286. 201-210 (1996)

    • 説明
      「研究成果報告書概要(欧文)」より
  • [文献書誌] T.Daniel, H.Nagao, H.Nakajima, K., A.Nakamura: "Seven-coordinated 2,2' : 6'2"-Terpyridinemolybdenum (II) Complexes : Synthesis, Structure and Reactivity of [Mo (CO) (C_7H_8) (4,4', 4"-R_3terpy) X] X' (R=H or tBu)" J.Organomet.Chem.509. 225-234 (1996)

    • 説明
      「研究成果報告書概要(欧文)」より
  • [文献書誌] K.Mashima, T.Tanaka, M.Kaidzu, A.Nakamura: "cis-iso-Specific Polymerization of Norbornenes by a Unique Combination of Cp^<**> and 1,3-Butadiene Ligands on Tantalum : Crystal Structures of Cp^<**> (eta^4-C_4H_6) Ta (CH_2Ph)_2 and Cp^<**> (eta^4-C_4H_6) Ta (=CHPh) (PMe_3)." Organometallics. 15. 2431-2433 (1996)

    • 説明
      「研究成果報告書概要(欧文)」より
  • [文献書誌] M.Nakano, S.Yamada, I.Shigemoto, K.Yamaguchi: "Dynamic (hyper) polarizability density analysis based on virtual excitation processes : Visuallization of dynamic electron fluctuatability of systemsunder time-dependent external electric fields." Chem.Phys.Lett.250. 247-254 (1996)

    • 説明
      「研究成果報告書概要(欧文)」より
  • [文献書誌] Y.Yoshioka, S.Yamada, T.Kawakami, M.Nishino, K.Yamaguchi, I.Saito: "Ab Initio Molecular Orbital Studies of Singlet Oxygen Reactions of Olefins, Enol Ethers, and Enamines." Bull.Chem.Soc.Jpn. 69. 2638-2699 (1996)

    • 説明
      「研究成果報告書概要(欧文)」より
  • [文献書誌] Y.Yoshioka, S.Yamanaka, S.Yamada, T.Kawakami, M.Nishino, K.Yamaguchi, A.Nishinaga: "Theoretical and Experimental Studies of a Charge-Transfer Mechanism for Biomimetic Oxygenations of Phenol and Indol Derivatives." Bull.Chem.Soc.Jpn.69. 2701-2722 (1996)

    • 説明
      「研究成果報告書概要(欧文)」より
  • [文献書誌] T.Kawakami, A.oda, W.Mori, K.Yamaguchi, K.Inoue, H.Iwamura: "THeoretical Studies of the Ferromagnetic Intermolecular Interaction of p-Carboxylate Phenyl Nitronyl Nitroxide." Mol.Cryst.Liq.Cryst.279. 29-38 (1996)

    • 説明
      「研究成果報告書概要(欧文)」より
  • [文献書誌] M.Nakano, Y.Matsuzaki, H.Nagao, S.Yamada, I.Shigemoto, K.Yamaguchi: "Damping wave packets approach : a caluculation method of intensity-dependent nonlinear optical susceptibilities including effects of nuclear motions at finite temperatures." Chem.Phys.Lett.258. 307-315 (1996)

    • 説明
      「研究成果報告書概要(欧文)」より
  • [文献書誌] H.Oku, N.Ueyama , A.Nakamura: "A Comparison between the Structures of Tungstopterin Cofactor in Tungsten Oxidoreductase and a Model Complex, cis-Dioxobis (2,3-naphthalenedithiolate) tungsten (VI) in Their O-Atom Transfer Reaction." Chem.Lett.1996. 31-32 (1996)

    • 説明
      「研究成果報告書概要(欧文)」より
  • [文献書誌] H.Oku, N.Ueyama, A.Nakamura: "Stbilization of Oxo-Metal Bonding by the pi-Conjugated System in Dithiolate Ligandsxis : cis-Dioxotungsten (VI) Bis (naphthalenedithiolato) and the Related Complexes as Modeles for Tungsten Oxidoreductases" Bull.Chem.Soc.Jpn.69. 3139-3150 (1996)

    • 説明
      「研究成果報告書概要(欧文)」より
  • [文献書誌] Y.Yoshioka, D.Yamaki, G.Maruta, T.Tsunesada, K.Takada, T.Noro, K.Yamaguchi: "NO-Theoretical Description of Electronic Structures of Tricentric Bis-desmiphiles in the Ground and Excited States." Bull.Chem.Soc.Jpn. 69. 3395-3415 (1996)

    • 説明
      「研究成果報告書概要(欧文)」より
  • [文献書誌] T.Ueno, N.Ueyama, A.Nakamura: "Redox Behavior of 4Fe-4S Ferredoxin Model Arenethiolate Complexes Involving Specific NHS Hydrogen Bonds Assisted by a Neighboring phenyl Group." J.Chem.Soc., Dalton Trans.1996. 3859-3863 (1996)

    • 説明
      「研究成果報告書概要(欧文)」より
  • [文献書誌] M.Nakano, S.Yamada, I.Shigemoto, K.Yamaguchi: "Theoretical study on the geometry dependence of the second hyperpolarizability of allyl cation based on a numerical Liouvile three-type analysis." Chem.Phys.Lett.251. 391-396 (1996)

    • 説明
      「研究成果報告書概要(欧文)」より
  • [文献書誌] H.Nakano, A.Nakamura, K.Mashima: "Linear Trinuclear Pt・・・Mo-Mo Complexes [Mo_2PtX_2 (pyphos)_2 (O_2CR)_2]_2 (X = Cl, Br, I ; R = CH_3, C (CH_3)_3 ; pyphos = 6-diphenylphosphino-2-pyridonate) with an Axial Interaction between the Quadruply Bonded Mo_2 Moiety and the Platinum Atom." Inorg.Chem.35. 4007-4012 (1996)

    • 説明
      「研究成果報告書概要(欧文)」より
  • [文献書誌] K.Mashima, M.Tanaka, K.Tani, H.Nakano, A.Nakamura: "Dinuclear Pd (I) -Pd (I) and Pt (II) ・・・Pt (II) Complexes Supportadby Tridentate PyphosLigands (pyphos = 6- (dephenylphosphino) -2-pyridonate)." Inorg.Chem.35. 5244-5248 (1996)

    • 説明
      「研究成果報告書概要(欧文)」より
  • [文献書誌] N.Ueyama, H.Oku, M.Kondo, T.-A.Okamura, N.Yoshinaga, A.Nakamura: "Trans Influence of Oxo and Dithiolene Coordination in Oxidized Models of Molybdenum Oxidoredactase : Synthesis, Structures, and Properties of Q_2 [MoVIO_2 (1,2- benzenedithiolato)_2] (Q=NEt_4, PPh_4) and Related Complexes." Inorg.Chem.35. 643-650 (1996)

    • 説明
      「研究成果報告書概要(欧文)」より
  • [文献書誌] N.Ueyama, Y.Yamada, T.-A.Okamura, S.Kimura, A.Nakamura: "Structure and Properties of [Fe_4S_4 {2,6-bis (acylamino) -benzenethiolato-S}_4 ]^<2-> and [Fe_2S_2 {2,6-bis (acylamino) -benzenethiolato-S}_4]^<2-> : Protection of the Fe-S Bond by Double NH・・・S Hydrogen Bonds." Inorg.Chem.35. 6473-6484 (1996)

    • 説明
      「研究成果報告書概要(欧文)」より
  • [文献書誌] M.Nakano, S.Kiribayachi, S.Yamada, I.Shigemoto, K.Yamaguchi: "Theoretical study of the second hyperpolarizabilities of three charged states of pentalene. A consideration of the structure-property correlation for the sensitive second hyper polarizability." Chem.Phys.Lett.262. 66-73 (1996)

    • 説明
      「研究成果報告書概要(欧文)」より
  • [文献書誌] Y.Nakayama, H.Saito, and A.Nakamura: "Selective Synthesis of Tungsten (VI) Mono (catecholato) Complexes Using 1,2-Bis (trimethylsiloxy) benzenes : Molecular Structure of WCl_4 (O_2C_6H_4)." Chem.Lett.1996. 691-692 (1996)

    • 説明
      「研究成果報告書概要(欧文)」より
  • [文献書誌] M.Nishino, S.Yamanaka, Y.Yoshioka, K.Yamaguchi: "Theoretical Approaches to Direct Exchange Coupling between Divalent Chromium Ions in Naked Dimer, Tetramer and Clusters" J.Phys.Chem.101. 705-712 (1996)

    • 説明
      「研究成果報告書概要(欧文)」より
  • [文献書誌] H.Nagao, M.Nakano, S.Yamanaka, Y.Shigeta, S.Yamada, D.Yamaki, I.Shigemoto, S.Kiribayashi, K.Yamaguchi: "Many-Electron-Wavepackets Method." Int.J.Quantum Chem.60. 79-89 (1996)

    • 説明
      「研究成果報告書概要(欧文)」より
  • [文献書誌] H.Takahashi, T.Kasai, K.Yamaguchi: "Wave Packet Simulation on the Cage Effect in the Full Scarrering : CF3H + Ar (3P) -CF3^<**> +H + Ar" Chem.Lett.1996. 793-794 (1996)

    • 説明
      「研究成果報告書概要(欧文)」より
  • [文献書誌] Y.Nakayama, T.Shibahara, H.Fukumoto, A.Nakamura, K.Mashima: "Syndiospecific Polymerization of Methyl Methacrylate Catalyzed by Lanthanoid Thiolate Complexes Bearing Hexamethyl phosphoric Triamide Ligand." Macromolecules. 29. 8014-8016 (1996)

    • 説明
      「研究成果報告書概要(欧文)」より
  • [文献書誌] K.Hatanaka, Y.Morita, T.Ohba, K.Yamaguchi, T.Takui, M.Kinoshita, K.Nakasuji: "Detection of New Neutral Radicals : 2-Phenyl-and 2-P-Methoxyphenhyl-3-oxophenalenoxyl Radicals." Tetrahedron Lett. 37. 873-876 (1996)

    • 説明
      「研究成果報告書概要(欧文)」より
  • [文献書誌] K.Mashima, H.Nakano, A.Nakamura: "Reductive Formation of Straight Linear Metal-Metal Bonded Tetranuclear Complexes X-M-Mo-Mo-M-X from X_2M・・・Mo-Mo・・・MX_2 Supported by Four Tridentate 6-Diphenylphosphino-2-pyridonate Ligands (M = Pd, Pt ; X = Cl, Br, I)." J.Am.Chem.Soc.118. 9083-9095 (1996)

    • 説明
      「研究成果報告書概要(欧文)」より
  • [文献書誌] K.Mashima, Y.Nakayama, T.Shibahara, H.Fukumoto, A.Nakamura: "Synthesis of Arenethiolate Complexes of Divalent and Trivalent Lanthanides from Metallic Lanthanides and Diaryl Disulfides : Crystal Structures of [{Yb (hmpa)_3}_2 (mu-SPh)_3] [SPh] and Ln (SPh)_3 (hmpa)_3 (Ln = Sm, Yb ; hmpa = hexamethylphosphoric triamide)" 35. 93-99 (1996)

    • 説明
      「研究成果報告書概要(欧文)」より
  • [文献書誌] M.Nakano, H.Nagao, K.Yamaguchi: "Many-electron Hyperpolarizability Density Analysis : Application to Dissociation Process of One-Dimensional H2" Phys.Rev.A. 55. 1503-1513 (1997)

    • 説明
      「研究成果報告書概要(欧文)」より
  • [文献書誌] S.Takeda, H.Fukumoto, K.Mashima, G.Maruta, K.Yamaguchi, A.Nakamura: "Thermochromismand Dynamics of Organometallis Conjugated Systems + Zirconocene Complex of 1,4-Diphynyl-1,3-butadiene" J.Phys.Chem.101. 278-284 (1997)

    • 説明
      「研究成果報告書概要(欧文)」より
  • [文献書誌] H.Takahashi, T.Kasai, K.Yamaguchi: "Wavepacket Dynamics in the Full Reaction of CF3H + Ar (3P) -CF3^<**> + H + Ar : Quantum Interference for the H-end Orientation" Chem.Phys.Lett.264. 44-50 (1997)

    • 説明
      「研究成果報告書概要(欧文)」より
  • [文献書誌] H.Nagao, K.Kawabe, K.Kodama, Y.Shigeta, K.Nishikawa, M.Nakano, K.Yamaguchi: "Nonadiabatic Treatment of Molecular System by the Wavepacket Method" Int.J.Quant.Chem.60. 49-58 (1997)

    • 説明
      「研究成果報告書概要(欧文)」より
  • [文献書誌] T.Kawakami, A.Oda, S.Takeda, W.Mori, T.Ishida, M.Yasui, F.Iwasaki, T.Nogami, K.Yamaguchi: "Magnetic Interaction via b-Hydrogen Atomsin TEMPO Derivatives." Mol.Cryst.Liq.Cryst.(in press). (1997)

    • 説明
      「研究成果報告書概要(欧文)」より

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公開日: 1999-03-16  

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