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ETS-NOCV description of σ-hole bonding
The ETS-NOCV analysis was applied to describe the σ-hole in a systematic way in a series of halogen compounds, CF(3)-X (X = I, Br, Cl, F), CH(3)I, and C(CH3)(n)H(3-n)-I (n = 1,2,3), as well as for the example germanium-based systems. GeXH(3), X = F, Cl, H. Further, the ETS-NOCV analysis was used to...
| Autores principales: | , , |
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| Formato: | Online Artículo Texto |
| Lenguaje: | English |
| Publicado: |
Springer-Verlag
2012
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| Materias: | |
| Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3693432/ https://www.ncbi.nlm.nih.gov/pubmed/23053006 http://dx.doi.org/10.1007/s00894-012-1591-0 |