E-mail

E-mail a Wiley Online Library Link

Moyocoyani Molina-Espíritu, Rodolfo O. Esquivel, Juan Carlos Angulo, Juan Antolín, Cristina Iuga and Jesús S. Dehesa Information-theoretical analysis for the SN2 exchange reaction CH3Cl + F− International Journal of Quantum Chemistry 113

Article first published online: 17 JUL 2013 | DOI: 10.1002/qua.24510

Thumbnail image of graphical abstract

Information-theoretical concepts, such as localization, order, and uniformity, offer a unique advantage as a complementary reactivity theory to provide a full description of chemical reactions, revealing chemical aspects of reactions that are not present in the energy-based interpretative approach. These kinds of analyses reveal the concomitant physical processes involved in the reaction: charge transferring, bond breaking, electrostatic equalization, bond forming, and electrostatic repulsion.

Complete the form below and we will send an e-mail message containing a link to the selected article on your behalf

Required = Required Field

Choose captcha format: Image or Audio. Click here if you need help.

SEARCH