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A combined experimental and quantum chemical (DFT and AIM) study on molecular structure, spectroscopic properties, NBO and multiple interaction analysis in a novel ethyl 4-[2-(carbamoyl)hydrazinylidene]-3,5-dimethyl-1H-pyrrole-2-carboxylate and its dimer

EngineeringNatural SciencesCombined ExperimentalOrganic ChemistryComputational ChemistryMultiple Interaction AnalysisQuantum ChemistryChemistryQuantum ChemicalMolecular ChemistrySpectra-structure CorrelationBiomolecular Engineering