Solvation Structures and Deactivation Pathways of Luminescent Isothiazole-Derived Nucleobases: tzA, tzG, and tzI

Adalberto Vasconcelos Sanches de Araújo,Danillo Valverde,Sylvio Canuto,Antonio Carlos Borin

Solvation Structures and Deactivation Pathways of Luminescent Isothiazole-Derived Nucleobases: tzA, tzG, and tzI

2020

Adalberto Vasconcelos Sanches de Araújo
Danillo Valverde
Sylvio Canuto
Antonio Carlos Borin

The photophysical relaxation pathways of tzA, tzG, and tzI luminescent nucleobases were investigated with the MS-CASPT2 quantum-chemical method and double-ζ basis sets (cc-pVDZ), in gas and condens...

Keywords:

Solvation
Chemistry
Luminescence
Nucleobase
Isothiazole
Computational chemistry

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