Computational Study of Some 4’-Aryl-1,2,4-triazol-1-ium-4-R<sub>2</sub>-phenacylid Derivatives in Vacuum and Dimethylformamide

Computational Study of Some 4’-Aryl-1,2,4-triazol-1-ium-4-R<sub>2</sub>-phenacylid Derivatives in Vacuum and Dimethylformamide

Four carbanion monosubstituted 4’-aryl-1,2,4-triazol-1-ium-4-R<sub>2</sub>-phenacylids, used as precursors in obtaining new heterocyclic compounds, and their corresponding derivatives belonging to the <i>C<sub>2v</sub></i> point group of symmetry were studied by c...

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Bibliographic Details
Main Authors: Nicoleta Melniciuc Puica, Dan-Gheorghe Dimitriu, Gabriela Apreotesei, Ana Cezarina Moroșanu, Dana-Ortansa Dorohoi
Format: Article
Language:English
Published: MDPI AG 2022-10-01
Series:Symmetry
Subjects:
1,2,4-triazol-1-ium-phenacylids
computed physical-chemical parameters
molecular descriptors
visible electronic absorption spectra
Online Access:https://www.mdpi.com/2073-8994/14/10/2099

Internet

https://www.mdpi.com/2073-8994/14/10/2099

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