Spectroscopic studies (FTIR, FT-Raman and UV), potential energy surface scan, normal coordinate analysis and NBO analysis of (2R,3R,4R,5S)-1-(2-hydroxyethyl)-2-(hydroxymethyl) pipe... von Isac Paulraj, E., Muthu, S.

Volltext

Spectroscopic and molecular structure (monomeric and dimeric structure) investigation of 2-[(2-hydroxyphenyl) carbonyloxy] benzoic acid by DFT method: A combined experimental and t... von Muthu, S., Isac Paulraj, E.

Volltext

Molecular structure and spectroscopic characterization of ethyl 4-aminobenzoate with experimental techniques and DFT quantum chemical calculations von Muthu, S., Isac Paulraj, E.

Volltext

FT-IR, FT-Raman spectra and ab initio HF and DFT calculations of 7-chloro-5-(2-chlorophenyl)-3-hydroxy-2,3-dihydro-1H-1,4-benzodiazepin-2-one von Muthu, S., Prasath, M., Isac Paulraj, E., Arun Balaji, R.

Volltext

Molecular structure analysis and spectroscopic characterization of 5-ethyl-5-phenyl-1,3-diazinane-4,6-dione with experimental (FT-IR and FT-Raman) techniques and quantum chemical c... von Isac Paulraj, E., Muthu, S.

Volltext

Quantum mechanical study of the structure and spectroscopic (FTIR, FT-Raman), first-order hyperpolarizability and NBO analysis of 1,2-benzoxazol-3-ylmenthane sulfonamide von Muthu, S., Ramachandran, G., Isac Paulraj, E., Swaminathan, T.

Volltext

Spectroscopic studies, potential energy surface and molecular orbital calculations of pramipexole von Muthu, S., Uma Maheswari, J., Srinivasan, S., Isac paulraj, E.

Volltext

Synthesis, characterization, spectroscopic studies, DFT and molecular docking analysis of N4, N4′-dibutyl-3, 3′-diaminobenzidine von Vijayakumar, Veeraragavan, Prabakaran, Arunachalam, Radhakrishnan, Narayanaswamy, Muthu, Sambanthan, Rameshkumar, Chidambaram, Isac Paulraj, E.

Volltext

Molecular structure, vibrational spectra, first order hyper polarizability, NBO and HOMO–LUMO analysis of 4-amino-3(4-chlorophenyl) butanoic acid von Muthu, S., Paulraj, E. Isac

Volltext

Spectroscopic characterization, electronic transitions and pharmacodynamic analysis of 1-Phenyl-1,3-butanedione: An effective agent for antipsychotic activity von Lawrence, M., Paulraj, E. Isac, Rajesh, P.

Volltext

Spectroscopic (FT-IR, FT-Raman, NMR and UV–visible), ADMET and molecular docking investigation of aztreonam as anti-tuberculosis agent von Mani, N., Suresh, S., Govindammal, M., Kannan, S., Paulraj, E. Isac, Nicksonsebastin, D., Prasath, M.

Volltext

Synthesis, characterization, spectroscopic studies, DFT and molecular docking analysis of N, N′-dibutyl-3, 3′-diaminobenzidine von Vijayakumar, Veeraragavan, Prabakaran, Arunachalam, Radhakrishnan, Narayanaswamy, Muthu, Sambanthan, Rameshkumar, Chidambaram, Isac Paulraj, E.

Volltext

Solvation Analysis of Halogenated 4-Oxoimidazo[5,1-d][1,2,3,5]tetrazine-8-carboxamide von Muthu, S., Paulraj, E. Isac

Volltext

Molecular structure, vibrational spectra and 13C and 1H NMR spectral analysis of 1-methylnaphthalene by ab initio HF and DFT methods von Shailajha, S., Rajesh Kannan, U., Sheik Abdul Kadhar, S.P., Isac Paulraj, E.

Volltext