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The nature of G⋯E–Y σ(3c–4e) in o-Me(n)GCH(2)C(6)H(4)EY (Me(n)G = Me(2)N and MeE; E = O, S, Se and Te; Y = F, Cl, Br, EMe and Me) with contributions from CT and compliance constants in noncovalent G⋯E interactions
The intrinsic dynamic and static nature of G–*–E–*–Y σ(3c–4e) interactions was elucidated with the quantum theory of atoms in molecules dual functional analysis (QTAIM-DFA), employing o-Me(n)GCH(2)C(6)H(4)EY (Me(n)G = Me(2)N and MeE; E = O, S, Se and Te; Y = F, Cl, Br, I, EMe and Me). Asterisks (*)...
Autores principales: | , , , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
The Royal Society of Chemistry
2019
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9076098/ https://www.ncbi.nlm.nih.gov/pubmed/35540683 http://dx.doi.org/10.1039/c9ra09022c |