Synthesis and Electronic Structure Elucidation of Multi-Phenalenyl Compounds linked by acetylene
Project/Area Number |
19550039
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Research Category |
Grant-in-Aid for Scientific Research (C)
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Allocation Type | Single-year Grants |
Section | 一般 |
Research Field |
Organic chemistry
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Research Institution | Osaka University |
Principal Investigator |
KUBO Takashi Osaka University, 大学院・理学研究科, 教授 (60324745)
|
Project Period (FY) |
2007 – 2008
|
Project Status |
Completed (Fiscal Year 2008)
|
Budget Amount *help |
¥4,810,000 (Direct Cost: ¥3,700,000、Indirect Cost: ¥1,110,000)
Fiscal Year 2008: ¥1,820,000 (Direct Cost: ¥1,400,000、Indirect Cost: ¥420,000)
Fiscal Year 2007: ¥2,990,000 (Direct Cost: ¥2,300,000、Indirect Cost: ¥690,000)
|
Keywords | 強相関電子系 / 磁性 / 光物性 / 有機導体 / フェナレニル / アセチレン / シングレットビラジカル |
Research Abstract |
一般に反応活性中間体として扱われている一重項ビラジカル種を、不対電子非局在化能の高いフェナレニル骨格を利用して熱力学的に安定化させ結晶として単離し、固体物性すなわち分子集合状態の物性を明らかにした。精査の結果、一重項ビラジカルは分子内と分子間で不対電子間相互作用を共存させる、という従来にはない概念を見出した。得られた化合物は両性FET特性を示し、また大きな二光子吸収断面積を有するなど、一重項ビラジカル種の優れた機能も明らかとなった。
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Report
(3 results)
Research Products
(83 results)
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[Journal Article] Tetrahedral Oligothiophenes ; Synthesis, X-ray Analysis, and Optoelectronic Properties of Highly Symmetrical, 3D-Branched Oligothiophenes. Matsumoto2008
Author(s)
K. ; Tanaka, T. ; Kugo, S. ; Inagaki, T. ; Hirao, Y. ; Kurata, H. ; Kawase, T. ; Kubo, T.
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Journal Title
Chem. Asian J. 3
Pages: 2024-2032
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[Journal Article] Theoretical study of third-order nonlinear optical properties in square nanographenes with open-shell singlet ground states. Nakano2008
Author(s)
M. ; Nagai, H. ; Fukui, H. ; Yoneda, K. ; Kishi, R. ; Takahashi, H. ; Shimizu, A. ; Kubo, T. ; Kamada, K. ; Ohta, K. ; Champagne, B. ; Botek, E. Chem
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Journal Title
Phys. Lett. 467
Pages: 120-125
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[Journal Article] Theoretical Study on Second Hyperpolarizabilities of Singlet Diradical Square Planar Nickel Complexes Involving o-Semiquinonato Type Ligands2008
Author(s)
Fukui, H. ; Kishi, R. ; Minami, T. ; Nagai, H. ; Takahashi, H. ; Kubo, T. ; Kamada, K. ; Ohta, K. ; Champagne, B. ; Botek, E. ; Nakano, M.
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Journal Title
J. Phys. Chem. A 112
Pages: 8423-8429
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[Journal Article] Intermolecular interaction effects on the second hyperpolarizability of open-shell singlet diphenalenyl radical dimer2008
Author(s)
Nakano, M. ; Takebe, A. ; Kishi, R. ; Fukui, H. ; Minami, T. ; Kubota, K. ; Takahashi, H. ; Kubo, T. ; Kamada, K. ; Ohta, K. ; Champagne, B. ; Botek, E.
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Journal Title
Chem. Phys. Lett. 454
Pages: 97-104
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[Journal Article] Theoretical study on the second hyperpolarizability of open-shell singlet one-dimensional systems with a charged defect2008
Author(s)
Takebe, A., Nakano, M., Kishi, R., Nate, M., Takahashi, H., Kubo, T., Kamada, K., Ohta, K., Champagne, B., Botek, E.
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Journal Title
Chem. Phys. Lett. 451
Pages: 111-115
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[Journal Article] Finite-Field Spin-Flip Configuration Interaction Calculation of the Second Hyperpolarizabilities of Singlet Diradical Systems2007
Author(s)
Kishi, R. ; Nakano, M. ; Ohta, S. ; Takebe, A. ; Nate, M. ; Takahashi, H. ; Kubo, T. ; Kamada, K. ; Ohta, K. ; Champagne, B. ; Botek, E.
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Journal Title
J. Chem. Theor. Comp. 3
Pages: 1699-1707
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[Journal Article] Second Hyperpolarizabilities of Singlet Polycyclic Diphenalenyl Radicals : Effects of the Nature of the Central Heterocyclic Ring and Substitution to Diphenalenyl Rings2007
Author(s)
Nakano, M. ; Nakagawa, N. ; Kishi, R. ; Ohta, S. ; Nate, M. ; Takahashi, H. ; Kubo, T. ; Kamada, K. ; Ohta, K. ; Champagne, B. ; Botek, E. ; Morita, Y. ; Nakasuji, K. ; Yamaguchi, K.
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Journal Title
Phys. Chem. A. 111(37)
Pages: 9102-9110
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[Journal Article] First and second hyperpolarizabilities of donor-acceptor disubstituted diphenalenyl radical systems.2007
Author(s)
Nakano, M. ; Ohta, S. ; Tokushima, K. ; Kishi, R. ; Kubo, T. ; Kamada, K. ; Ohta, K. ; Champagne, B. ; Botek, B. ; Takahashi, H.
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Journal Title
Chem. Phys. Lett. 443
Pages: 95-101
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[Journal Article] Ambipolar Organic Field-Effect Transistors Based on a Narrow Bandgap Semiconductor with Balanced Hole and Electron Mobilities2007
Author(s)
Chikamatsu, M. ; Mikami, T. ; Chisaka, J. ; Shimizu, A. ; Kubo, T. ; Morita, Y. ; Nakasuji, K. ; Yoshida, Y. ; Azumi, R. ; Yase, K.
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Journal Title
Appl. Phys. Lett. 91
Pages: 43506-43506
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[Journal Article] Theoretical Study on the Second Hyperpolarizabilities of Phenalenyl Radical Systems Involving Acetylene and Vinylene Linkers : Diradical Character and Spin Multiplicity Dependences.2007
Author(s)
Ohta, S. ; Nakano, M. ; Kubo, T. ; Kamada, K. ; Ohta, K. ; Kishi, R. ; Nakagawa, N. ; Champagne, B. ; Botek, E. ; Takebe, A. ; Umezaki, S.-y. ; Nate, M. ; Takahashi, H. ; Furukawa, S.-i. ; Morita, Y. ; Nakasuji, K. ; Yamaguchi, K. J.
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Journal Title
Phys. Chem. A. 111(18)
Pages: 3633-3641
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[Journal Article] Strong Two-Photon Absorption of Singlet Diradical Hydrocarbons2007
Author(s)
Kamada, K. ; Ohta, K. ; Kubo, T. ; Shimizu, A. ; Morita, M. ; Nakasuji, K. ; Kishi, R. ; Ohta, S. ; Furukawa, S. ; Takahashi, H. ; Nakano, M.
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Journal Title
Angew. Chem. Int. Ed. 46
Pages: 3544-3546
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