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Spectral features, electric properties, NBO analysis and reactivity descriptors of 2-(2-Benzothiazolylthio)-Ethanol: Combined experimental and DFT studies

EngineeringChemical AnalysisNatural SciencesSpectra-structure CorrelationNbo AnalysisPhysical ChemistryOrganic ChemistrySpectral FeaturesComputational ChemistryChemistryQuantum ChemistryReactivity DescriptorsMolecule-based MaterialBiophysics