Solvation effect on the ESIPT mechanism of nitrile-substituted ortho-hydroxy-2-phenyl-oxazolines

In this study, density functional theory (DFT) and time-dependent density functional theory (TD-DFT) were used to unveil the solvation effects on the excited-state intramolecular proton transfer (ESIPT) of nitrile-substituted ortho-hydroxy-2-phenyl-oxazoline (NOHPO) molecules in three different solv...

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Detalles Bibliográficos
Autores principales: Zhang, Hengwei, Li, Wenzhi, Wang, Yuxi, Tao, Yaping, Wang, Yi, Yang, Fan, Gao, Ziqing
Formato: Online Artículo Texto
Lenguaje:English
Publicado: The Royal Society of Chemistry 2021
Materias:
Chemistry
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9037208/
https://www.ncbi.nlm.nih.gov/pubmed/35478890
http://dx.doi.org/10.1039/d1ra04033b

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9037208/
https://www.ncbi.nlm.nih.gov/pubmed/35478890
http://dx.doi.org/10.1039/d1ra04033b

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