Table 2 SVP values for normal modes of CH3I projected onto the reaction coordinates at transition states for the proton transfer and the nucleophilic substitution channel.
Proton transferNucleophilic substitution
CI stretch0.220.78
CH3 rocking0.090.00
CH3 umbrella0.760.24
CH3 deformation0.300.00
CH symmetric stretch0.330.03
CH asymmetric stretch0.100.00
Translation0.020.16