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Synthesis, X-ray, spectroscopy, molecular docking and DFT calculations of (E)-N'-(2,4-dichlorobenzylidene)-5-phenyl-1H-pyrazole-3-carbohydrazide

Khalid Karrouchi, Silvia Antonia Brandán, Mubashir Hassan, Khalid Bougrin, Smaail Radi, Marilena Ferbinţeanu, Yann Garcia, M’hammed Ansar

2020Journal of Molecular Structure33 citationsDOIOpen Access PDF

Topics & Concepts

ChemistryCarbohydrazidePyrazoleNatural bond orbitalCrystallographyHydrogen bondIntramolecular forceMoleculeMulliken population analysisBond orderAqueous solutionComputational chemistryCrystal structureBond lengthDensity functional theoryStereochemistryPhysical chemistryMedicinal chemistryOrganic chemistryNonlinear Optical Materials ResearchMetal complexes synthesis and propertiesSynthesis and Characterization of Heterocyclic Compounds
Synthesis, X-ray, spectroscopy, molecular docking and DFT calculations of (E)-N'-(2,4-dichlorobenzylidene)-5-phenyl-1H-pyrazole-3-carbohydrazide | Litcius