T. Rajamani

Electronic absorption, vibrational spectra, non-linear optical properties, NBO analysis and thermodynamic properties of 9-[(2-hydroxyethoxy) methyl] guanine molecule by density functional method

T. Rajamani, S. Muthu · Solid State Sciences · 2012 · 82 citations

Natural Sciences, Chemistry, Physics +17

Electronic absorption, vibrational spectra, nonlinear optical properties, NBO analysis and thermodynamic properties of N-(4-nitro-2-phenoxyphenyl) methanesulfonamide molecule by ab initio HF and density functional methods

T. Rajamani, S. Muthu, M. Karabacak · Spectrochimica Acta Part A Molecular and Biomolecular Spectroscopy · 2013 · 60 citations

Natural Sciences, Chemistry, Physics +17

Vibrational and UV spectra, first order hyperpolarizability, NBO and HOMO–LUMO analysis of 4-chloro-N-(2-methyl-2,3-dihydroindol-1-yl)-3-sulfamoyl-benzamide

S. Muthu, T. Rajamani, M. Karabacak et al. · Spectrochimica Acta Part A Molecular and Biomolecular Spectroscopy · 2013 · 27 citations

Natural Sciences, Chemistry, Physics +14

Computational, Reactivity, Fukui Function, Molecular Docking, and Spectroscopic Studies of a Novel (E)-1-Benzyl-3-(2-(Pyrindin-2-yl)Hydrazono)Indolin-2-One

Dhakshinamurthy Divya, Venkatesan Srinivasan, A. Prabakaran et al. · Polycyclic aromatic compounds · 2023 · 14 citations

Natural Sciences, Chemistry, Medicinal Chemistry +17

Computational insight into the spectroscopic and molecular docking analysis of estrogen receptor with ligand 2,3-dimethyl-N[2-(hydroxy)benzylidene] aniline

A. Prabakaran, J. Uma Maheswari, Noureddine Issaoui et al. · Journal of King Saud University - Science · 2024 · 14 citations · Full text

Natural Sciences, Chemistry, Physics +17