Systematic Comparisons between Broken Symmetry and Symmetry-Adapted Approaches to Transition States by Chemical Indices: A Case Study of the Diels−Alder Reactions-Reference-Cited by-同舟云学术

Systematic Comparisons between Broken Symmetry and Symmetry-Adapted Approaches to Transition States by Chemical Indices: A Case Study of the Diels−Alder Reactions

Published:2003-01-04 Issue:5 Volume:107 Page:682-694
ISSN:1089-5639
Container-title:The Journal of Physical Chemistry A
language:en
Short-container-title:J. Phys. Chem. A

Author:

Isobe Hiroshi¹,Takano Yu¹,Kitagawa Yasutaka¹,Kawakami Takashi¹,Yamanaka Syusuke¹,Yamaguchi Kizashi¹,Houk K. N.¹

Affiliation:

1. Department of Chemistry, Graduate School of Science, Osaka University, Osaka, 560-0043, Japan, and Department of Chemistry and Biochemistry, University of California at Los Angeles, Los Angeles, California 90095-1565

Publisher

American Chemical Society (ACS)

Subject

Physical and Theoretical Chemistry

Link

https://pubs.acs.org/doi/pdf/10.1021/jp021125o

Reference98 articles.

1. The Conservation of Orbital Symmetry

2. Pericyclic Reaction Transition States: Passions and Punctilios, 1935-1995

3. Density Functional Theory Prediction of the Relative Energies and Isotope Effects for the Concerted and Stepwise Mechanisms of the Diels−Alder Reaction of Butadiene and Ethylene

4. Density functional theory calculations of pericyclic reaction transition structures

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