Article ID | Journal | Published Year | Pages | File Type |
---|---|---|---|---|
5395165 | Computational and Theoretical Chemistry | 2011 | 12 Pages |
Keywords
Sequential proton loss electron transferPCMPDEZPESPLETDFTROSα-TocopherolProton dissociation enthalpyAntioxidantSubstituent effectHydrogen atom transferZero point energyETEPolarized continuum modelDensity functional theoryproton affinityIonization potentialHATelectron withdrawing groupelectron donating groupReactive oxygen species
Related Topics
Physical Sciences and Engineering
Chemistry
Physical and Theoretical Chemistry
Authors
Meysam Najafi, Kaveh Haghighi Mood, Mansour Zahedi, Erik Klein,