Vibrational Spectra, Normal Coordinate Analysis, and Structure of Keto Form of Acetylacetone: A DFT Approach

Synthesis, DFT Calculations and Spectral Characterization of Novel pyrimidine and pyrazoline Derivatives

Synthesis, spectroscopic, DFT and docking studies, molecular structure of new Schiff base metal complexes

Normal coordinate analyses and spectroscopic studies of benzalbarbituric acid complexes

Electronic Structure, Spectra and Chemical Reactivity Descriptors of Some Novel Rhodanine Derivatives. Density Functional Theory Approach

DFT, Electronic absorption spectra and Non-linear optical properties of some 4H-benzo[h]chromene Derivatives. Solvent effect and TD-DFT Approach

EXPERIENCE IN ANALYZING VIBRATIONAL SPECTRA OF SOLIDS AND SOLID-SOLID INTERACTIONS

Design, Spectroscopic Characterization, Thermal, 3D Molecular Modeling, XRD and in Vitro Antioxidant and Antimicrobial Screening of Novel N2O2 Tetradentate Schiff’s Base Metal Com

Synthesis, Characterization and Theoretical Study of Azoimine and Using for Analysis of Palladium (II) Ion by Turbidimetric Method in Environmental Samples

Electronic Structure, Global Reactivity Descriptors and Nonlinear Optical Properties of Some Novel pyrazolyl quinolinone Derivatives. DFT approach