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Synthesis, XRD crystal structure, spectroscopic characterization (FT-IR, 1H and 13C NMR), DFT studies, chemical reactivity and bond dissociation energy studies using molecular dynamics simulations and evaluation of antimicrobial and antioxidant activities of a novel chalcone derivative, (E)-1-(4-bromophenyl)-3-(4-iodophenyl)prop-2-en-1-one

Novel Chalcone DerivativeBiochemistryNatural SciencesMolecular Dynamics SimulationsOrganic ChemistryXrd Crystal StructureChemistryHeterocycle ChemistryDerivative (Chemistry)Synthetic Chemistry