The calculated activation energy of the decomposition reaction of 3-sulfolene inside the carcerand is slightly higher than that of the free species, which is consistent with experimental observation.

• 结果表明，3-环丁烯砜在杯芳烃分子反应器中发生分解反应的活化能比在自由状态下反应的活化能略高，这与3-环丁烯砜在杯芳烃中的表观分解温度提高的实验现象吻合。