Spin−Orbit Coupling Patterns Induced by Twist and Pyramidalization Modes in C2H4: A Quantitative Study and a Qualitative Analysis-Reference-Cited by-同舟云学术

Spin−Orbit Coupling Patterns Induced by Twist and Pyramidalization Modes in C2H4: A Quantitative Study and a Qualitative Analysis

Published:1998-06-20 Issue:29 Volume:102 Page:5923-5936
ISSN:1089-5639
Container-title:The Journal of Physical Chemistry A
language:en
Short-container-title:J. Phys. Chem. A

Author:

Danovich David¹,Marian Christel M.¹,Neuheuser Thomas¹,Peyerimhoff Sigrid D.¹,Shaik Sason¹

Affiliation:

1. Department of Organic Chemistry and the Lise Meitner-Minerva Center for Computational Quantum Chemistry, The Hebrew University, 91904 Jerusalem, Israel, and Institut für Physikalische und Theoretische Chemie, Universität Bonn, Wegelerstrasse 12, D-53115 Bonn, Germany

Publisher

American Chemical Society (ACS)

Subject

Physical and Theoretical Chemistry

Link

https://pubs.acs.org/doi/pdf/10.1021/jp980391s

Reference50 articles.

1. The Electronic Properties of Diradicals

2. Qualitative potential energy surfaces. 3. Stereoselection rules for spin inversion in triplet photochemical reactions

3. Spin-inversion and orbital symmetry conspiracy in type A lumiketone rearrangements

4. Triplet [2 + 2] cycloadditions. Spin-inversion control of stereoselectivity

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