Akhil R. Krishnan

Vibrational spectroscopic study and NBO analysis on bis(4-amino-5-mercapto-1,2,4-triazol-3-yl) methane using DFT method

S. Subashchandrabose, Akhil R. Krishnan, H. Saleem et al. · Spectrochimica Acta Part A Molecular and Biomolecular Spectroscopy · 2010 · 53 citations

Natural Sciences, Chemistry, Physics +15

FT-IR, FT-Raman, NMR spectral analysis and theoretical NBO, HOMO–LUMO analysis of bis(4-amino-5-mercapto-1,2,4-triazol-3-yl)ethane by ab initio HF and DFT methods

S. Subashchandrabose, Akhil R. Krishnan, H. Saleem et al. · Journal of Molecular Structure · 2010 · 43 citations

Natural Sciences, Chemistry, Materials Science +14

Quantum Mechanical Studies of Three Aromatic Halogen-Substituted Bioactive Sulfonamidobenzoxazole Compounds with Potential Light Harvesting Properties

Y. Sheena Mary, Tuğba Ertan‐Bolelli, Renjith Thomas et al. · Polycyclic aromatic compounds · 2019 · 43 citations

Natural Sciences, Chemistry, Medicinal Chemistry +16

Molecular structure, vibrational spectroscopic (FT-IR, FT-Raman), UV and NBO analysis of 2-chlorobenzonitrile by density functional method

Akhil R. Krishnan, H. Saleem, S. Subashchandrabose et al. · Spectrochimica Acta Part A Molecular and Biomolecular Spectroscopy · 2010 · 41 citations

Natural Sciences, Chemistry, Organic Chemistry +15

FT-IR, FT-Raman spectra and scaled quantum mechanical study of 4-amino-1-benzylpiperidine

Swaroop Chandra, H. Saleem, Y. Erdoğdu et al. · Journal of Molecular Structure · 2011 · 17 citations

Natural Sciences, Chemistry, Materials Science +14