Theoretical structural analysis (FT-IR, FT-R), solvent effect on electronic parameters NLO, FMO, NBO, MEP, UV (IEFPCM model), Fukui function evaluation with pharmacological analysis on methyl nicotinate

Journal article

Peer reviewed

M. Vennila, R. Rathikha, S. Muthu, A. Jeelani and Ahmad Irfan

Computational and theoretical chemistry, Vol.1217, p.113890

11/2022

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Title: Theoretical structural analysis (FT-IR, FT-R), solvent effect on electronic parameters NLO, FMO, NBO, MEP, UV (IEFPCM model), Fukui function evaluation with pharmacological analysis on methyl nicotinate
Creators - without role: M. Vennila - University of Madras
R. Rathikha
S. Muthu
A. Jeelani
Ahmad Irfan
Publication Details: Computational and theoretical chemistry, Vol.1217, p.113890
Identifiers: 9922911908331
Academic Unit: King Khalid University
Language: English
Resource Type: Journal article