Quantum-Chemical Investigation of the Conformational Dynamics of Mono-meso-phenyl-Substituted Octaalkylporphyrins in the Triplet Excited State

2004 ◽  
Vol 108 (26) ◽  
pp. 5684-5691 ◽  
Author(s):  
Igor V. Avilov ◽  
Eduard I. Zenkevich ◽  
Evgeny I. Sagun ◽  
Igor V. Filatov
Keyword(s):  
Excited State ◽  
Quantum Chemical ◽  
Conformational Dynamics ◽  
Chemical Investigation ◽  
Triplet Excited State ◽  
Quantum Chemical Investigation

Quantum chemical investigation of the ground- and excited-state acidities of a dihydroxyfuranoflavylium cation

2021 ◽  
Vol 140 (7) ◽  
Author(s):  
Jing Cui ◽  
Farhan Siddique ◽  
Reed Nieman ◽  
Gustavo T. M. Silva ◽  
Frank H. Quina ◽  
...  
Keyword(s):  
Excited State ◽  
Quantum Chemical ◽  
Chemical Investigation ◽  
Quantum Chemical Investigation

Photo-redox coupled Co-pincer complexes for efficient decarbonylation of aryl carbonyls: A quantum chemical investigation

2021 ◽  
Vol 507 ◽  
pp. 111553
Author(s):  
Animesh Chowdhury ◽  
Santu Biswas ◽  
Sourav Ghoshal ◽  
Anup Pramanik ◽  
Pranab Sarkar
Keyword(s):  
Quantum Chemical ◽  
Chemical Investigation ◽  
Pincer Complexes ◽  
Quantum Chemical Investigation
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