S. Balachandran

Structural insights, spectral, flourescence, Z-scan, C-H…O/N-H…O hydrogen bonding and AIM, RDG, ELF, LOL, FUKUI analysis, NLO activity of N-2(Methoxy phenyl) acetamide

M. Jini Pramila, D. Arul Dhas, I. Hubert Joe et al. · Journal of Molecular Structure · 2022 · 99 citations

Natural Sciences, Chemistry, Pharmacology +12

Spectroscopic and quantum chemical computation on molecular structure, AIM, ELF, RDG, NCI, and NLO activity of 4-VINYL benzoic acid: A DFT approach

R. Sukanya, D. Aruldhas, I. Hubert Joe et al. · Journal of Molecular Structure · 2021 · 92 citations

Natural Sciences, Chemistry, Physics +17

Experimental and theoretical spectroscopic analysis, hydrogen bonding, reduced density gradient and antibacterial activity study on 2-Phenyl quinoline alkaloid

J. Priscilla, D. Arul Dhas, I. Hubert Joe et al. · Chemical Physics · 2020 · 37 citations

Natural Sciences, Chemistry, Medicinal Chemistry +14

DFT computation and experimental analysis of vibrational and electronic spectra of phenoxy acetic acid herbicides

D. Arul Dhas, I. Hubert Joe, S.D.D. Roy et al. · Spectrochimica Acta Part A Molecular and Biomolecular Spectroscopy · 2013 · 36 citations

Natural Sciences, Chemistry, Physics +17

Spectroscopic analysis and charge transfer interaction studies of 4-benzyloxy-2-nitroaniline insecticide: A density functional theoretical approach

D. Arul Dhas, I. Hubert Joe, S.D.D. Roy et al. · Spectrochimica Acta Part A Molecular and Biomolecular Spectroscopy · 2014 · 32 citations

Natural Sciences, Chemistry, Spectroscopic Analysis +12