Experimental IR, Raman, and UV-Vis Spectra DFT Structural and Conformational Studies: Bioactivity and Solvent Effect on Molecular Properties of Methyl-Eugenol

Experimental IR, Raman, and UV-Vis Spectra DFT Structural and Conformational Studies: Bioactivity and Solvent Effect on Molecular Properties of Methyl-Eugenol

Structural, conformational, and spectroscopic investigations of methyl-eugenol were made theoretically at the <i>B3LYP-6-311++G**level. Experimental</i> IR, Raman, and UV-vis spectra were investigated and analyzed in light of the computed quantities. Conformational analysis was carried o...

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Bibliographic Details
Main Authors:	Rohit Kumar Yadav, Bhoopendra Yadav, R. A. Yadav, Irena Kostova
Format:	Article
Language:	English
Published:	MDPI AG 2023-07-01
Series:	Molecules
Subjects:	structural conformational and vibrational studies MEP HOMO-LUMO analysis IR Raman and UV-vis spectra
Online Access:	https://www.mdpi.com/1420-3049/28/14/5409

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