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Quantum mechanical and spectroscopic (FT-IR, FT-Raman) study, NBO analysis, HOMO-LUMO, first order hyperpolarizability and molecular docking study of methyl[(3R)-3-(2-methylphenoxy)-3-phenylpropyl]amine by density functional method

Molecular SpectroscopyNatural SciencesMolecule-based MaterialSpectra-structure CorrelationNbo AnalysisComputational ChemistryQuantum ChemistryChemistryDensity Functional MethodMolecular Docking StudyBiophysics