首页 | 本学科首页   官方微博 | 高级检索  
     


Dynamic Behavior of Organic Reactive Intermediates
Authors:Barry K. Carpenter
Abstract:An unexpected yes is the answer the author gives to the following questions: If a reactive intermediate was faced with two equally high energy barriers to product formation, could the kinetic product ratio ever be anything other than 1:1? If the two barriers were of unequal height, could there ever be a preference to form the product that corresponds to the higher barrier pathway? The basis for this yes are the results from molecular dynamics simulations and experiments that suggest that the interpretation of reaction mechanisms by statistical models is not always correct.
Keywords:Computer chemistry  Diradicals  Kinetics  Molecular dynamics  Supercritical fluids  Computer chemistry  Diradicals  Kinetics  Molecular dynamics  Supercritical fluids
设为首页 | 免责声明 | 关于勤云 | 加入收藏

Copyright©北京勤云科技发展有限公司  京ICP备09084417号