Computational investigations into hydrogen-atom abstraction from rhodium hydride complexes by methyl radicals in aqueous solution

Keyphrases

• Aqueous Solution 100%
• Hydrogen Abstraction 100%
• Cyclam 100%
• Methyl Radical 100%
• Hydride Complexes 100%
• Rhodium Hydride 100%
• Computational Investigation 100%
• Density Functional Theory 50%
• Effect Value 50%
• Mechanistic Pathway 50%
• Abstraction Reaction 50%
• Kinetic Isotope Effect 50%
• Reaction Mechanism 25%
• Methane 25%
• Hydrogen Peroxide 25%
• Order of Magnitude 25%
• Reaction Rate 25%
• H Atoms 25%
• Chloride 25%
• Low Energy nuclear Reactions 25%
• Radical Propagation 25%
• Propagation Mechanism 25%

Chemistry

• Hydrogen Atom 100%
• Rhodium 100%
• Aqueous Solution 100%
• Density Functional Theory 66%
• Kinetic Isotope Effect 66%
• Methane 33%
• Rate Constant 33%