Article ID | Journal | Published Year | Pages | File Type |
---|---|---|---|---|
5416317 | Journal of Molecular Structure: THEOCHEM | 2010 | 4 Pages |
Abstract
The interaction between CdS and acetylacetone as a complexing agent is examined. We have performed conformational searches, optimizations and frequency calculations in the MP2/LANL2DZ level of theory. The importance of acetylacetone lies in its ability to tautomerize and form stable compounds through the accessibility of the physical position of its oxygens.
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Authors
Aned de Leon, M.C. Acosta-EnrÃquez, Abraham F. Jalbout, A. Apolinar-Iribe, S.J. Castillo,