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2012 Fiscal Year Final Research Report

Ion Cluster Spectroscopy for Chemical Intermediates of Nucleophilic Addition and Substitution Reactions

Research Project

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Project/Area Number 21350016
Research Category

Grant-in-Aid for Scientific Research (B)

Allocation TypeSingle-year Grants
Section一般
Research Field Physical chemistry
Research InstitutionHiroshima University

Principal Investigator

INOKUCHI Yoshiya  広島大学, 大学院・理学研究科, 准教授 (30311187)

Co-Investigator(Kenkyū-buntansha) EBATA Takayuki  広島大学, 大学院・理学研究科, 教授 (70142924)
Project Period (FY) 2009 – 2012
Keywordsクラスター
Research Abstract

We produced chemical intermediates and/or reaction products of nucleophilic addition and substitution reactions of ions in vacuum. Absorption spectra of these molecular cluster ions in the UV~IR region were measured by mass-selected photodissociation spectroscopy in the gas phase. The structure of these species was determined by analyzing the spectra with the aid of quantum chemical calculations.

  • Research Products

    (28 results)

All 2013 2012 2011 2010 2009

All Journal Article (23 results) (of which Peer Reviewed: 23 results) Presentation (4 results) Book (1 results)

  • [Journal Article] Microhydration Effects on the Intermediates of the SN2 Reaction of Iodide Anion with Methyl Iodide2013

    • Author(s)
      K. DOI:, E. Togano, S. S. Xantheas, R. Nakanishi, T. Nagata, T. Ebata, and Y. Inokuchi
    • Journal Title

      Angew. Chem. Int.

      Volume: 52 Pages: 4380-4383

    • DOI

      DOI:10.1002/anie.201207697

    • Peer Reviewed
  • [Journal Article] Study on Vibrational Relaxation Dynamics of Phenol-Water Complex by Picosecond Time-Resolved IR-UV Pump-Probe Spectroscopy in a Supersonic Molecular Beam2013

    • Author(s)
      Y. Miyazaki, Y. Inokuchi, T. Ebata, and M. Petkovic
    • Journal Title

      Chem. Phys.

      Volume: (in press)

    • Peer Reviewed
  • [Journal Article] Laser Spectroscopic Study of Cold Host-Guest Complexes of Crown Ethers in the Gas Phase2013

    • Author(s)
      Y. Inokuchi, R. Kusaka, T. Ebata, O. V. Boyarkin, and T. R. Rizzo
    • Journal Title

      Chem Phys Chem.

      Volume: 14 Pages: 649-660

    • DOI

      DOI:10.1002/cphc.201200746

    • Peer Reviewed
  • [Journal Article] Laser Spectroscopic Study ofβ-Estradiol and Its Monohydrated Clusters in a Supersonic Jet2012

    • Author(s)
      F. Morishima, Y. Inokuchi, and T. Ebata
    • Journal Title

      J. Phys. Chem. A

      Volume: 116 Pages: 8201-8208

    • DOI

      DOI:10.1021/jp302209z

    • Peer Reviewed
  • [Journal Article] Anionic Polymerization Mechanism of Acrylonitrile Trimer Anions: Key Branching Point between Cyclization and Chain Propagation2012

    • Author(s)
      K. Ohshimo, Y. Inokuchi, T. Ebata, and K. Ohno
    • Journal Title

      J. Phys. Chem. A

      Volume: 116 Pages: 7937-7942

    • DOI

      DOI:10.1021/jp305291r

    • Peer Reviewed
  • [Journal Article] Laser Spectroscopic Study of Encapsulation Complexes in the Gas Phase -Molecular Level Understanding of the Encapsulation Mechanism of Host-Guest Complexes-2012

    • Author(s)
      T. Ebata and Y. Inokuchi
    • Journal Title

      Mol. Sci.

      Volume: 6 Pages: A0051

    • URL

      http://j-molsci.jp/article/2012_1.html

    • Peer Reviewed
  • [Journal Article] Structures of (3n-crown-n)-Phenol (n= 4, 5, 6, 8) Host-Guest Complexes: Formation of a Uniquely Stable Complex for n= 6 via Collective Intermolecular Interaction2012

    • Author(s)
      R. Kusaka, Y. Inokuchi, T. Haino, and T. Ebata
    • Journal Title

      J. Phys. Chem. Lett.

      Volume: 3 Pages: 1414-1420

    • DOI

      DOI:10.1021/jz300313d

    • Peer Reviewed
  • [Journal Article] Ion Selectivity of Crown Ethers Investigated by UV and IR Spectroscopy in a Cold Ion Trap2012

    • Author(s)
      Y. Inokuchi, O. V. Boyarkin, R. Kusaka, T. Haino, T. Ebata, and T. R. Rizzo
    • Journal Title

      J. Phys. Chem. A

      Volume: 116 Pages: 4057-4068

    • DOI

      DOI:10.1021/jp3011519

    • Peer Reviewed
  • [Journal Article] Nonradiative Decay Dynamics of Methyl-4-Hydroxycinnamate and Its Hydrated Complex Revealed by Picosecond Pump-Probe Spectroscopy2012

    • Author(s)
      D. Shimada, R. Kusaka, Y. Inokuchi, M. Ehara, and T. Ebata
    • Journal Title

      Phys. Chem. Chem. Phys.

      Volume: 14 Pages: 8999-9005

    • DOI

      DOI:10.1039/C2CP24056D

    • Peer Reviewed
  • [Journal Article] UV and IR Spectroscopy of Cold 1,2-Dimethoxybenzene Complexes with Alkali Metal Ions2012

    • Author(s)
      Y. Inokuchi, O. V. Boyarkin, T. Ebata, and T. R. Rizzo
    • Journal Title

      Phys. Chem. Chem. Phys.

      Volume: 14 Pages: 4457-4462

    • DOI

      DOI:10.1039/C2CP24018A

    • Peer Reviewed
  • [Journal Article] Vibrational Energy Relaxation of Benzene Dimer and Trimer in the CH Stretching Region Studied by Picosecond Time-Resolved IR-UV Pump-Probe Spectroscopy2012

    • Author(s)
      R. Kusaka, Y. Inokuchi, and T. Ebata
    • Journal Title

      J. Chem. Phys.

      Volume: 136 Pages: 044304-12

    • DOI

      DOI:10.1063/1.3676658

    • Peer Reviewed
  • [Journal Article] Laser Spectroscopic and Theoretical Studies of Encapsulation Complexes of Calix[4]arene2011

    • Author(s)
      S. Kaneko, Y. Inokuchi, T. Ebata, E. Apra, and S. S. Xantheas
    • Journal Title

      J. Phys. Chem. A

      Volume: 115 Pages: 10846-10853

    • DOI

      DOI:10.1021/jp204577j

    • Peer Reviewed
  • [Journal Article] UV and IR Spectroscopic Studies of Cold Alkali Metal Ion-Crown Ether Complexes in the Gas Phase2011

    • Author(s)
      Y. Inokuchi, O. V. Boyarkin, R. Kusaka, T. Haino, T. Ebata, and T. R. Rizzo
    • Journal Title

      J. Am. Chem. Soc.

      Volume: 133 Pages: 12256-12263

    • DOI

      DOI:10.1021/ja2046205

    • Peer Reviewed
  • [Journal Article] Structure of Host-Guest Complexes between Dibenzo-18-Crown-6 and Water, Ammonia, Methanol, and Acetylene: Evidence of Molecular Recognition on the Complexation2011

    • Author(s)
      R. Kusaka, S. Kokubu, Y. Inokuchi, T. Haino, and T. Ebata
    • Journal Title

      Phys. Chem. Chem. Phys.

      Volume: 13 Pages: 6827-6836

    • DOI

      DOI:10.1039/c0cp02523b

    • Peer Reviewed
  • [Journal Article] Structures and Encapsulation Motifs of Functional Molecules Probed by Laser Spectroscopic and Theoretical Methods2010

    • Author(s)
      R. Kusaka, Y. Inokuchi, S. S. Xantheas, and T. Ebata
    • Journal Title

      Sensors

      Volume: 10 Pages: 3519-3548

    • DOI

      DOI:10.3390/s100403519

    • Peer Reviewed
  • [Journal Article] Formation of Semi-Covalent Bond in [(N_2O)_nH_2O]^+(n= 2-7) Cluster Ions Studied by IR Spectroscopy2010

    • Author(s)
      R. Matsushima, T. Ebata, and Y. Inokuchi
    • Journal Title

      J. Phys. Chem. A

      Volume: 114 Pages: 11037-11042

    • DOI

      DOI:10.1021/jp100336h

    • Peer Reviewed
  • [Journal Article] Encapsulation of ArnComplexes by Calix[4]arene: Endo- vs. Exo-Complexes2010

    • Author(s)
      T. Ebata, N. Hontama, Y. Inokuchi, T. Haino, E. Apra, and S. S. Xantheas
    • Journal Title

      Phys. Chem. Chem. Phys.

      Volume: 12 Pages: 4569-4579

    • DOI

      DOI:10.1039/b927441c

    • Peer Reviewed
  • [Journal Article] Laser Spectroscopic Study on (Dibenzo-24-Crown-8-Ether)-Water and -Methanol Complexes in Supersonic Jets2010

    • Author(s)
      S. Kokubu, R. Kusaka, Y. Inokuchi, T. Haino, and T. Ebata
    • Journal Title

      Phys. Chem. Chem. Phys.

      Volume: 12 Pages: 3559-3565

    • DOI

      DOI:10.1039/b924822f

    • Peer Reviewed
  • [Journal Article] Structure of the Calix[4]arene-(H2O) Cluster: The World's Smallest Cup of Water2010

    • Author(s)
      N. Hontama, Y. Inokuchi, T. Ebata, C. Dedonder-Lardeux, C. Jouvet, and S. S. Xantheas
    • Journal Title

      J. Phys. Chem. A

      Volume: 114 Pages: 2967-297

    • DOI

      DOI:10.1021/jp902967q

    • Peer Reviewed
  • [Journal Article] Ion Core Structure in (N2O)n+(n= 2-8) Studied by Infrared Photodissociation Spectroscopy2009

    • Author(s)
      Y. Inokuchi, R. Matsushima, Y. Kobayashi, and T. Ebata
    • Journal Title

      J. Chem. Phys.

      Volume: 131 Pages: 044325-31

    • DOI

      DOI:10.1063/1.3194801

    • Peer Reviewed
  • [Journal Article] Water-Mediated Conformer Optimization of Benzo-18-Crown-6-Ether/Water System2009

    • Author(s)
      R. Kusaka, Y. Inokuchi, and T. Ebata
    • Journal Title

      Phys. Chem. Chem. Phys.

      Volume: 11 Pages: 9132-8948

    • DOI

      DOI:10.1039/b909618c

    • Peer Reviewed
  • [Journal Article] Structural Evolution of the [(CO2)n(H2O)]-Cluster Anions: Quantifying the Effect of Hydration on the Excess Charge Accommodation Motif2009

    • Author(s)
      A. Muraoka, Y. Inokuchi, N. Hammer, J.-W. Shin, M. A. Johnson, and T. Nagata
    • Journal Title

      J. Phys. Chem. A

      Volume: 113 Pages: 8942-8948

    • DOI

      DOI:10.1021/jp903578e

    • Peer Reviewed
  • [Journal Article] Structures of Water-CO_2 and Methanol-CO_2 Cluster Ions: [H_2O・(CO_2)_n]+and [CH_3OH・(CO_2)_n]+(n= 1-7)2009

    • Author(s)
      Y. Inokuchi, Y. Kobayashi, A. Muraoka, T. Nagata, and T. Ebata
    • Journal Title

      J. Chem. Phys.

      Volume: 130 Pages: 154304-16

    • DOI

      DOI:10.1063/1.3116144

    • Peer Reviewed
  • [Presentation] UV and IR Spectroscopic Studies of Cold Alkali Metal Ion-Benzo Crown Ether Complexes in the Gas Phase2012

    • Author(s)
      Yoshiya Inokuchi
    • Organizer
      International Symposium on Molecular Spectroscopy 67th Meeting
    • Place of Presentation
      The Ohio State University, Columbus, Ohio, USA
    • Year and Date
      2012-06-19
  • [Presentation] 極低温イオントラップ中の金属イオンークラウンエーテル錯体のレーザー分光2011

    • Author(s)
      井口佳哉
    • Organizer
      第5回分子科学討論会2011札幌
    • Place of Presentation
      札幌
    • Year and Date
      2011-09-21
  • [Presentation] Formation of Intermolecular Covalent Bonds Observed with IR Photodissociation Spectroscopy2010

    • Author(s)
      Yoshiya Inokuchi
    • Organizer
      Pacifichem2010
    • Place of Presentation
      Honolulu, Hawaii, USA
    • Year and Date
      2010-12-17
  • [Presentation] 3原子分子クラスターイオン内における分子間共有結合の形成と,その電子・幾何構造の研究2009

    • Author(s)
      井口佳哉
    • Organizer
      第3回分子科学討論会2009名古屋
    • Place of Presentation
      名古屋
    • Year and Date
      2009-09-24
  • [Book] Vibrational Spectroscopy2012

    • Author(s)
      T. Ebata, R. Kusaka, and Y. Inokuchi
    • Total Pages
      79-114
    • Publisher
      InTech

URL: 

Published: 2014-08-29  

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