THEORETICAL STUDY OF THE S²-P INTERACTION BETWEEN TL(I) AND OLEFINIC SYSTEMS ON HYPOTHETICAL [TL(c2H4)2]+ And [TL(c2H2)n]+ (N = 2,3) COMPLEXES
The attraction between [C2HJ2 and [C2HJ23 and Tl(I) in the hypothetical [Tl(C2H4)2]+ and [Tl(C2H2)n]+ (n = 2,3) complexes was studied using ab initio methods. It was found that the changes around the equilibrium C-Tl distance and in the interaction energies are sensitive to the electron correlation...
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| Autores principales: | , |
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| Lenguaje: | English |
| Publicado: |
Sociedad Chilena de Química
2010
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| Acceso en línea: | http://www.scielo.cl/scielo.php?script=sci_arttext&pid=S0717-97072010000400020 |
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