Table of Contents
Journal of Quantum Chemistry
Volume 2014, Article ID 239845, 19 pages
Research Article

Understanding the Polar Character Trend in a Series of Diels-Alder Reactions Using Molecular Quantum Similarity and Chemical Reactivity Descriptors

1Departamento de Ciencias Químicas, Universidad Nacional Andres Bello, República 275, 8370146 Santiago, Chile
2Grupo de Química Cuántica y Teórica, Programa de Química, Facultad de Ciencias Exactas y Naturales, Universidad de Cartagena, Colombia

Received 1 March 2014; Revised 4 April 2014; Accepted 4 April 2014; Published 7 July 2014

Academic Editor: Daniel Glossman-Mitnik

Copyright © 2014 Alejandro Morales-Bayuelo and Ricardo Vivas-Reyes. This is an open access article distributed under the Creative Commons Attribution License, which permits unrestricted use, distribution, and reproduction in any medium, provided the original work is properly cited.

Supplementary Material

In the SI is possible see a discussion on the charge transfer and the polar character in the Diels-Alder reactions and also the coordinates of the structures studies.

  1. Supplementary Material