Computational study on kinetics and mechanism of Cl-initiated hydrogen abstraction of methyl fluoroacetate

The reaction kinetics of the H-atom abstraction reaction of methyl fluoroacetate with Cl-atoms are investigated at G2(MP2)//MPWB1K/6-31+G(d,p) level of theory. The rate constants of reactions are determined for the first time in a wide temperature range of 250-450 K.