Platinum (II) catalyzed transformations of a dialkynylphosphine coordinated platinum(II) complex.
Theoretical investigation of the rearrangement reaction was carried out. The relative energies of the reactant and possible products were determined using a hybrid QM/MM method with the ONIOM approach. The theoretical results indicate that the lower energy structures were those of the experimenta...
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| Formato: | Tese |
| Idioma: | English |
| Publicado em: |
2008
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| Acesso em linha: | http://hdl.handle.net/10356/14254 |