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Theoretical study of the bonding of the first-row transition-metal positive ions to ethylene
- Source :
- Journal of Physical Chemistry. 96(5, 19)
- Publication Year :
- 1992
- Publisher :
- United States: NASA Center for Aerospace Information (CASI), 1992.
-
Abstract
- Ab initio calculations were performed to study the bonding of the first-row transition-metal ions with ethylene. While Sc(+) and Ti(+) insert into the pi bond of ethylene to form a three-membered ring, the ions V(+) through Cu(+) form an electrostatic complex with ethylene. The binding energies are compared with those from experiment and with those of comparable calculations performed previously for the metal-acetylene ion systems.
- Subjects :
- Inorganic And Physical Chemistry
Subjects
Details
- Language :
- English
- ISSN :
- 00223654
- Volume :
- 96
- Issue :
- 5, 19
- Database :
- NASA Technical Reports
- Journal :
- Journal of Physical Chemistry
- Publication Type :
- Report
- Accession number :
- edsnas.19920071665
- Document Type :
- Report
- Full Text :
- https://doi.org/10.1021/j100184a020