Published January 26, 1972
| public
Journal Article
Theoretical investigations of the trimethylene biradical
- Creators
- Hay, P. J.
- Hunt, W. J.
-
Goddard, W. A., III
Abstract
There is currently much interest in establishing the mechanisms and potential surfaces involved in the geometric and structural isomerizations of small cyclic compounds such as cyclopropane. We report here the results of ab initio calculations on several configurations of trimethylene (open cyclopropane) using the generalized valence bond (GVB) method.
Additional Information
© 1976 American Chemical Society Received September 7, 1971. Partially supported by a grant (PF-013) front the President's Fund of the California Institute of Technology and by a grant (GP15423) from the National Science Foundation.Additional details
- Eprint ID
- 109757
- DOI
- 10.1021/ja00757a057
- Resolver ID
- CaltechAUTHORS:20210709-153802732
- NSF Graduate Research Fellowship
- National Defense Science and Engineering Graduate (NDSEG) Fellowship
- Alfred P. Sloan Foundation
- Caltech President's Fund
- GP-15423
- NSF
- Created
-
2021-07-09Created from EPrint's datestamp field
- Updated
-
2021-11-16Created from EPrint's last_modified field
- Other Numbering System Name
- Arthur Amos Noyes Laboratory of Chemical Physics
- Other Numbering System Identifier
- 4269