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Spectrochimica Acta. Part A, Molecular and Biomolecular Spectroscopy|June 25, 2013
Vibrational spectral investigations and density functional theory study of 4-Formylbenzoic acidT S Xavier, I Hubert Joe, M A Palafox, et al.
Spectrochimica Acta. Part A, Molecular and Biomolecular Spectroscopy|January 2, 2003
Vibrational spectroscopic studies on the natural product, columbianadinJose P Abraham, I Hubert Joe, V George, et al.
Spectrochimica Acta. Part A, Molecular and Biomolecular Spectroscopy|May 13, 2014
Studies on molecular structure, vibrational spectra and molecular docking analysis of 3-Methyl-1,4-dioxo-1,4-dihydronaphthalen-2-yl 4-aminobenzoateD M Suresh, M Amalanathan, I Hubert Joe, et al.
Spectrochimica Acta. Part A, Molecular and Biomolecular Spectroscopy|April 16, 2013
Simulation of a tetramer form of 5-chlorouracil: the vibrational spectra and molecular structure in the isolated and in the solid state by using DFT calculationsS Ortiz, M Alcolea Palafox, V K Rastogi, et al.
Spectrochimica Acta. Part A, Molecular and Biomolecular Spectroscopy|September 25, 2012
Vibrational spectral investigation and Natural Bond Orbital analysis of anti-rheumatoid drug ethyl 4-nitrophenylacetate--DFT approachD M Suresh, M Amalanathan, S Sebastian, et al.
Spectrochimica Acta. Part A, Molecular and Biomolecular Spectroscopy|December 3, 2014
FT-IR and FT-Raman spectra, MEP and HOMO-LUMO of 2,5-dichlorobenzonitrile: DFT studyM Alcolea Palafox, Daisy Bhat, Yasha Goyal, et al.
Spectrochimica Acta. Part A, Molecular and Biomolecular Spectroscopy|April 9, 2013
Structural conformations and density functional study on the intramolecular charge transfer based on vibrational spectra of 2,4-dihydroxy-N'-(4-methoxybenzylidene)benzohydrazideD M Suresh, D Sajan, Yun-Peng Diao, et al.
Heliyon|October 6, 2023
Enhanced NLO response and switching self-focussing in benzodiazepine derivative with -NO2 and -Br substitutionAswathy P, I Hubert Joe, B Narayana, et al.
Spectrochimica Acta. Part A, Molecular and Biomolecular Spectroscopy|September 15, 2024
Solvent effect, DFT and NLO studies of A-π-D-π-A and A-π-D-π-D push-pull chromophore of 1,2-diazepin-4-ol based derivatives with optical limiting applicationP Aswathy, I Hubert Joe, B Narayana, et al.
Spectrochimica Acta. Part A, Molecular and Biomolecular Spectroscopy|August 28, 2013
FT-IR, FT-Raman spectra and other molecular properties of 3,5-dichlorobenzonitrile: a DFT studyM Alcolea Palafox, V Bena Jothy, Surabhi Singhal, et al.
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