Journal of Physical Chemistry, Vol.98, No.50, 13357-13372, 1994
Radical Chemistry in Methane Oxidative Coupling - Tracing of Ethylene Secondary Reactions with Computer-Models and Isotopes
The reaction pathways of ethylene during methane oxidative coupling over (Li)MgO catalysts were investigated by detailed isotopic analysis of all the products from (C2H4)-C-12:(CH4)-C-13:O-2 reactant mixtures. Ethylene oxidation has little effect on the concurrent methane conversion, even at comparable mole fractions. By comparison with an extensive computer model of the gas-phase chemistry, the surface is seen to effectively quench much of the oxidative gas-phase radical chemistry. The detailed C-3 and C-4 hydrocarbon yields and isotopic distributions, however, are well described by gas-phase hydrocarbon radical pathways.
Keywords:PROMOTED MAGNESIUM-OXIDE;GAS-PHASE;HIGHER HYDROCARBONS;LI/MGO CATALYST;CONVERSION;OXYGEN;ETHANE;DIMERIZATION;SIMULATION;INHIBITION