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J-GLOBAL ID：201902247463484675   Reference number：19A1315033

Investigation into the molecular and electronic structures of a newly synthesized o-quinone derivative

新しく合成したo-キノン誘導体の分子構造と電子構造の研究【JST・京大機械翻訳】

Author (5)： Hamamoto Nobutsugu (Department of Chemistry, Graduate School of Science and Technology, Kumamoto University, 2-39-1 Kurokami, Chuo-ku, Kumamoto 860-8555, Japan) ,  Arae Sachie (Department of Chemistry, Faculty of Advanced Science and Technology, Kumamoto University, 2-39-1 Kurokami, Chuo-ku, Kumamoto 860-8555, Japan) ,  Moriguchi Tetsuji (Department of Applied Chemistry, Faculty of Engineering, Kyushu Institute of Technology, 1-1 Sensui-cho, Tobata-ku, Kitakyushu 804-8550, Japan) ,  Irie Ryo (Department of Chemistry, Faculty of Advanced Science and Technology, Kumamoto University, 2-39-1 Kurokami, Chuo-ku, Kumamoto 860-8555, Japan) ,  Fujimoto Hitoshi (Department of Chemistry, Faculty of Advanced Science and Technology, Kumamoto University, 2-39-1 Kurokami, Chuo-ku, Kumamoto 860-8555, Japan)
Material： Chemical Physics  (Chem Phys)
Volume： 524  Page： 77-84  Publication year： 2019 
JST Material Number： D0167B  ISSN： 0301-0104  Document type： Article
Article type： 原著論文  Country of issue： Netherlands (NLD)  Language： ENGLISH (EN)

Abstract/Point： We studied on the geometric an...

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Thesaurus term： t-butyl group ,  time dependence ,  electron affinity ,  model compound ,  *molecular structure ,  density functional method ,  crystal ,  *electronic structure ,  optimization ,  ionization potential ,  cyclic voltammetry ,  powder ,  reduction potential ,  hydrogen atom ,  modification ,  quinone ,  alicyclic compound ,  conjugated diene

Author keywords (3)： Density functional theory ,  Electronic structure ,  O-Benzoquinone

JST classification (1)： Electronic structure of molecules  (BH05010Q)

Substance index (1)： o-Benzoquinone

Terms in the title (5)： o-キノン ,  誘導体 ,  分子構造 ,  電子構造 ,  研究