Twisted Intramolecular Charge Transfer States in 2-Arylbenzotriazoles:  Fluorescence Deactivation via Intramolecular Electron Transfer Rather Than Proton Transfer

2002 ◽  
Vol 106 (34) ◽  
pp. 7680-7689 ◽  
Author(s):  
Ashok Maliakal ◽  
George Lem ◽  
Nicholas J. Turro ◽  
Ravi Ravichandran ◽  
Joseph C. Suhadolnik ◽  
...  

2020 ◽  
Vol 124 (47) ◽  
pp. 9738-9750
Author(s):  
Suneel Gangada ◽  
Ramya Athira Ramnagar ◽  
Akanksha Ashok Sangolkar ◽  
Ravinder Pawar ◽  
Jagadeesh Babu Nanubolu ◽  
...  


2016 ◽  
Vol 4 (14) ◽  
pp. 2731-2743 ◽  
Author(s):  
Shunsuke Sasaki ◽  
Gregor P. C. Drummen ◽  
Gen-ichi Konishi

Twisted intramolecular charge transfer (TICT) is an electron transfer process that occurs upon photoexcitation in molecules that usually consist of a donor and acceptor part linked by a single bond.



2009 ◽  
Vol 08 (supp01) ◽  
pp. 1073-1086
Author(s):  
YUANZUO LI ◽  
SHASHA LIU ◽  
LILI ZHAO ◽  
MAODU CHEN ◽  
FENGCAI MA ◽  
...  

In this paper, the two-dimensional (2D) site and the three-dimensional (3D) cube representations [Sun MT, J Chem Phys124: 054903, 2006] have been further developed to study the charge transfer during excited-state relaxation. With these newly developed representations, we theoretically investigate the excited-state intramolecular electron transfer (ESIET) in enol excited-state geometry relaxation, and ESIET coupled with excited-state intramolecular proton transfer (ESIPT) in phototautomerization (in enol to keto transformation). The energy levels of highest occupied molecular orbital (HOMO) and lowest unoccupied molecular orbital (LUMO) of HBODC in enol and keto absorption and fluorescence are compared to understand photoinduced ESIET and ESIPT process. The excited regions of molecule (where arrangement of electron density takes place during excited-state relaxation) are located with 2D site representation. 3D cube representations visualize the character of charge transfer (CT) in those regions. Results of the research indicate that the ability of charge transfer during enol excited-state geometry relaxation is much stronger than that in phototautomerization.



2021 ◽  
Author(s):  
Yunjian Cao ◽  
Lingling Wang ◽  
Ziqi Liu ◽  
Chaofan Sun ◽  
Yuanzuo Li

A fluorescent probe 2′-(2,4-dinitro-phenoxy)-4-(dimethylamino) chalcone (Pr1, Spectrochim. Acta, Part A 2021, 244, 118839)based on the twisted intramolecular charge transfer (TICT) and excited state intramolecular proton transfer (ESIPT) was designed and...



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