Li-ling Ai and Jing-yao Liu Theoretical study on the reaction of (Z)-CF3CHCHCF3 with OH radicals International Journal of Quantum Chemistry 114
Version of Record online: 23 AUG 2013 | DOI: 10.1002/qua.24535
Unsaturated hydrofluorocarbons containing CC bonds are investigated as environmentally friendly alternatives for chlorofluorocarbons and saturated hydrofluorocarbons in various applications. Theoretical calculations are carried out to elucidate the mechanism of the reaction of the model system (Z)-CF3CHCHCF3 with OH radicals in the absence and presence of O2/NO by means of density functional theory. Possible reaction pathways and products are investigated under the atmospheric condition. The calculated results agree well with experimental measurements.
Complete the form below and we will send an e-mail message containing a link to the selected article on your behalf
Required = Required Field