Investigating the influence of substituent groups in TTM based radicals for the excitation process: a theoretical study-Reference-Cited by-同舟云学术

Investigating the influence of substituent groups in TTM based radicals for the excitation process: a theoretical study

Published:2023 Issue:37 Volume:25 Page:25871-25879
ISSN:1463-9076
Container-title:Physical Chemistry Chemical Physics
language:en
Short-container-title:Phys. Chem. Chem. Phys.

Author:

Fei Lu-ran¹,Wang Jian¹,Bai Fu-quan¹^ORCID,Wang Shi-ping¹,Hu Bin¹,Kong Chui-peng¹^ORCID,Zhang Hong-xing¹

Affiliation:

1. Laboratory of Theoretical and Computational Chemistry, Institute of Theoretical, Chemistry, College of Chemistry, Jilin University, 130023 Changchun, P. R. China

Abstract

The mode-average method was employed to compute the knr for several TTM-based radicals. The conjugated structures and the polarity of solvents can influence kr and knr. The fluorine substituted trichlorophenyl group can lead to a decrease of knr.

Funder

National Natural Science Foundation of China

Jilin University

Publisher

Royal Society of Chemistry (RSC)

Subject

Physical and Theoretical Chemistry,General Physics and Astronomy

Link

http://pubs.rsc.org/en/content/articlepdf/2023/CP/D3CP01248D

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