Rate constants of hydroperoxyl radical addition to cyclic nitrones: A DFT study

Physics & Astronomy

• antioxidants 62%
• density functional theory 51%
• reactivity 44%
• free energy 36%
• traps 33%
• oxides 27%
• electron affinity 25%
• reagents 25%
• ionization potentials 24%
• interactions 17%
• trapping 17%
• trends 16%
• damage 15%
• cells 12%
• electrons 9%

Chemical Compounds

• Hydroperoxyl 100%
• Radical Addition 80%
• Nitrone 78%
• Rate Constant 44%
• N-Oxide 18%
• Electron Spin 13%
• Antioxidant Agent 12%
• Gibbs Free Energy 12%
• Transition State Structure 10%
• Ionization Potential 8%
• Charge Density 8%
• Transition State 6%
• Density Functional Theory 5%
• Reduction 3%