(E)-2-((3-Nitrophenyl)Diazenyl)-3-Oxo-3-Phenylpropanal: Experimental, DFT Studies, and Molecular Docking Investigations
Ernest C. Agwamba, Hitler Louis, Innocent Benjamin, Chioma G. Apebende, Tomsmith O. Unimuke, Henry O. Edet, Akaninyene D. Udoikono, Adanna D. Nwagu, Adedapo S. Adeyinka
Topics & Concepts
Natural bond orbitalDensity functional theoryHOMO/LUMOHydrogen bondSolvationDocking (animal)Materials scienceChemistryComputational chemistryPhysical chemistryMoleculeOrganic chemistryMedicineNursingNonlinear Optical Materials ResearchMetal complexes synthesis and propertiesSynthesis and Characterization of Heterocyclic Compounds