Journal of Physical Chemistry A, Vol.110, No.40, 11401-11403, 2006
A possible union of chemical bonding, reactivity, and kinetics
In this communication, we report for the first time the reactivity behavior at the transition state, the connection between the equireactivity configuration and the activation barrier, and a possible principle of reactivity conservation along the reaction paths of typical thermoneutral and exo (endo) thermic reactions.