An analysis of spectroscopic, computational and biological activity studies of L-shaped sulfamoylbenzoic acid derivatives: A third order nonlinear optical material
Krishna Murthy Potla, Poojith Nuthalapati, Francisco A. P. Osório, Clodoaldo Valverde, Sampath Chinnam, P.A. Suchetan, Suneetha Vankayalapati
Topics & Concepts
ChemistryNatural bond orbitalIntramolecular forceAtoms in moleculesBasis setMoleculeComputational chemistryHydrogen bondMolecular orbitalFukui functionDensity functional theoryAtomic orbitalBond-dissociation energyPotential energy surfaceBond orderElectron localization functionCrystallographyBond lengthElectronStereochemistryQuantum mechanicsElectrophileOrganic chemistryPhysicsCatalysisNonlinear Optical Materials ResearchChemical synthesis and pharmacological studiesSynthesis and biological activity