This letter presents ab initio calculation of Captodative effect on 2,2,2-trifluoroethylamine free radical on STO-3G level. The △Ecd is -50. 15 kJ/mol, which means that this radical is of extra stabilization energy.
文摘This letter presents ab initio calculation of Captodative effect on 2,2,2-trifluoroethylamine free radical on STO-3G level. The △Ecd is -50. 15 kJ/mol, which means that this radical is of extra stabilization energy.
