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Spectroscopic (FT-IR, FT-Raman, UV-Vis) molecular structure, electronic, molecular docking, and thermodynamic investigations of indole-3-carboxylic acid by DFT method

M. Sathish, L. Rajasekaran, D. Shanthi, N. Kanagathara, S. Sarala, S. Muthu

2021Journal of Molecular Structure45 citationsDOI

Topics & Concepts

ChemistryNatural bond orbitalMoleculeRaman spectroscopyIntermolecular forceIndole testComputational chemistryDocking (animal)Physical chemistryStereochemistryOrganic chemistryPhysicsMedicineOpticsNursingNonlinear Optical Materials ResearchMetal complexes synthesis and propertiesSynthesis and biological activity
Spectroscopic (FT-IR, FT-Raman, UV-Vis) molecular structure, electronic, molecular docking, and thermodynamic investigations of indole-3-carboxylic acid by DFT method | Litcius