Kinetics for the reactions of phenyl with methanol and ethanol: Comparison of theory and experiment

Keyphrases

• Methanol 100%
• Ethanol 100%
• Phenyl 100%
• Comparison Experiment 100%
• Benzene 100%
• Theory Comparison 100%
• Temperature Range 33%
• Product Channel 33%
• Radical Source 33%
• Low Energy Barrier 33%
• Mass Spectrometry 16%
• Hydroxyl Group 16%
• Pulsed Laser 16%
• Acetophenone 16%
• Kinetic Model 16%
• Substitution Reaction 16%
• Laser Photolysis 16%
• Hydrogen Abstraction 16%
• Cavity Ring-down 16%
• Experimental Values 16%
• H-abstraction 16%
• Canonical Variational Transition State Theory 16%
• Weighted Least Squares 16%
• Least-squares Analysis 16%
• Microcanonical 16%
• Nitrobenzene 16%
• OH Groups 16%
• Low Temperature Measurements 16%
• B3LYP/6-311++G(d,p) 16%
• H-abstraction Reaction 16%
• Complementary Sets 16%
• Spectrometric Techniques 16%

Chemistry

• Methanol 100%
• Rate Constant 100%
• Energy Barrier 40%
• Hydrogen 20%
• Hydroxyl Group 20%
• Mass Spectrometry 20%
• Acetophenone 20%
• Photolysis 20%
• DFT-B3LYP Calculation 20%
• Substitution Reaction 20%
• Spectroscopy 20%
• Transition State Theory 20%
• Nitrosobenzene 20%
• Benzene 20%