Quantum chemical calculation, performance of selective antimicrobial activity using molecular docking analysis, RDG and experimental (FT-IR, FT-Raman) investigation of 4-[{2-[3-(4-chlorophenyl)-5-(4-propan-2-yl) phenyl)-4, 5-dihydro- 1H- pyrazol-1-yl]-4-oxo-1, 3- thiazol-5(4H)-ylidene} methyl] benzonitrile

The research received a great deal of worldwide attention due to the nature of interpretation before the experimental process. Based on the systematic process the structure of thiazole -pyrazole compound 4-[{2-[3-(4-chlorophenyl)-5-(4-propan-2-yl) phenyl)-4, 5-dihydro- 1H- pyrazol-1-yl]-4-oxo-1, 3-...

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Bibliographic Details
Main Authors: N. Shanmugapriya, V. Balachandran, B. Revathi, B. Narayana, Vinutha V. Salian, K. Vanasundari, C. Sivakumar
Format: Article
Language:English
Published: Elsevier 2021-07-01
Series:Heliyon
Subjects:
DFT
RDG
ELF
Online Access:http://www.sciencedirect.com/science/article/pii/S2405844021017370