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The Cis-Effect Explained Using Next-Generation QTAIM
We used next-generation QTAIM (NG-QTAIM) to explain the cis-effect for two families of molecules: C(2)X(2) (X = H, F, Cl) and N(2)X(2) (X = H, F, Cl). We explained why the cis-effect is the exception rather than the rule. This was undertaken by tracking the motion of the bond critical point (BCP) of...
| Autores principales: | , , , , , , , |
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| Formato: | Online Artículo Texto |
| Lenguaje: | English |
| Publicado: |
MDPI
2022
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| Materias: | |
| Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9506152/ https://www.ncbi.nlm.nih.gov/pubmed/36144830 http://dx.doi.org/10.3390/molecules27186099 |