| Literature DB >> 19235191 |
Lai Xu1, Charles E Doubleday, K N Houk.
Abstract
Getting the bends: The dynamics of 1,3-dipolar cycloaddition reactions have been explored by decomposing transition vector, quasi-classical trajectories, and single trajectories. Dipole bending (see picture) makes the largest contribution to the TS distortion energy and constitutes the major part of transition-state distortion energy in the favored concerted pathway.Entities:
Year: 2009 PMID: 19235191 DOI: 10.1002/anie.200805906
Source DB: PubMed Journal: Angew Chem Int Ed Engl ISSN: 1433-7851 Impact factor: 15.336