Solvent effects on the excited-state double proton transfer mechanism in the 7-azaindole dimer: a TDDFT study with the polarizable continuum model.

Yu, Xue-Fang; Yamazaki, Shohei; Taketsugu, Tetsuya

Yu, Xue-Fang; Yamazaki, Shohei; Taketsugu, Tetsuya.

Afiliação

Yu XF; The Laboratory of Theoretical and Computational Chemistry, School of Chemistry and Chemical Engineering, Yantai University, Yantai 264005, China. yuxuefang2008@gmail.com.
Yamazaki S; Department of Frontier Materials Chemistry, Graduate School of Science and Technology, Hirosaki University, Hirosaki 036-8561, Japan.
Taketsugu T; Department of Chemistry, Faculty of Science, Hokkaido University, Sapporo 060-0810, Japan.

Phys Chem Chem Phys ; 19(34): 23289-23301, 2017 Aug 30.

Article em En | MEDLINE | ID: mdl-28825761

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Texto completo: 1 Coleções: 01-internacional Base de dados: MEDLINE Idioma: En Revista: Phys Chem Chem Phys Assunto da revista: BIOFISICA / QUIMICA Ano de publicação: 2017 Tipo de documento: Article País de afiliação: China

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