Litcius/Paper detail

Synthesis, solvation effects, spectroscopic, chemical reactivity, topological analysis and biological evaluation of 4-chloro-N-(2, 6-dichlorobenzylidene) benzohydrazide

V. Rajmohan, S. Deepa, S. Asha, S. Priya, Abir Sagaama, M. Raja

2023Journal of Molecular Liquids13 citationsDOI

Topics & Concepts

Natural bond orbitalChemistryFukui functionSolvationDensity functional theoryBasis setComputational chemistryMoleculeMolecular orbitalExcited stateHOMO/LUMOElectrophilePhysical chemistryTopology (electrical circuits)Organic chemistryPhysicsAtomic physicsCombinatoricsCatalysisMathematicsNonlinear Optical Materials ResearchSynthesis and biological activityFree Radicals and Antioxidants