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Theoretical insights into excited-state hydrogen bonding effects and intramolecular proton transfer (ESIPT) mechanism for BTS system

In this work, N,N’-bis(salicylidene)-(2-(3′,4′-diaminophenyl)benzothiazole) (named as “BTS”) system was studied about its excited-state intramolecular proton transfer (ESIPT) process. The analyses about reduced density gradient (RDG) reveal the formation of two intramolecular hydrogen bonds in BTS s...

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Bibliografiske detaljer
Udgivet i:Sci Rep
Main Authors: Wang, Jiemin, Liu, Qiang, Yang, Dapeng
Format: Artigo
Sprog:Inglês
Udgivet: Nature Publishing Group UK 2020
Fag:
Online adgang:https://ncbi.nlm.nih.gov/pmc/articles/PMC7083891/
https://ncbi.nlm.nih.gov/pubmed/32198439
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1038/s41598-020-61804-7
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