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On the molecular structure, vibrational spectra, HOMO-LUMO, molecular electrostatic potential, UV–Vis, first order hyperpolarizability, and thermodynamic investigations of 3-(4-chlorophenyl)-1-(1yridine-3-yl) prop-2-en-1-one by quantum chemistry calculations

Natural SciencesMolecular Electrostatic PotentialSpectra-structure CorrelationComputational ChemistryQuantum ChemistryChemistryMolecular ChemistryQuantum Chemistry CalculationsBiophysics