Theoretical investigations on the antioxidant potential of a non-phenolic compound thymoquinone: a DFT approach
Jewel Hossen, M. Abbas Ali, Sultanur Reza
Topics & Concepts
ChemistryHOMO/LUMOBond-dissociation energyEnthalpyThymoquinoneProton affinityElectron affinity (data page)Ionization energyAntioxidantDissociation (chemistry)Computational chemistryMoleculePhotochemistryPhysical chemistryOrganic chemistryIonizationThermodynamicsIonProtonationPhysicsFree Radicals and AntioxidantsNigella sativa pharmacological applicationsBioactive Compounds and Antitumor Agents