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Exploring the excited state behavior for 2-(phenyl)imidazo[4,5-c]pyridine in methanol solvent

In this present work, we theoretically investigate the excited state mechanism for the 2-(phenyl)imidazo[4,5-c]pyridine (PIP-C) molecule combined with methanol (MeOH) solvent molecules. Three MeOH molecules should be connected with PIP-C forming stable PIP-C-MeOH complex in the S(0) state. Upon the...

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Detalhes bibliográficos
Publicado no:Sci Rep
Main Authors: Yang, Dapeng, Jia, Min, Wu, Jingyuan, Song, Xiaoyan
Formato: Artigo
Idioma:Inglês
Publicado em: Nature Publishing Group UK 2017
Assuntos:
Acesso em linha:https://ncbi.nlm.nih.gov/pmc/articles/PMC5601927/
https://ncbi.nlm.nih.gov/pubmed/28916799
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1038/s41598-017-12146-4
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