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3-Chloro-N,N-di­methyl­propan-1-aminium chloride

The organic cation in the title mol­ecular salt, C(5)H(13)NCl(+)·Cl(−), exhibits the gauche effect with a C—H bond of the C atom β to the chloro group donating electrons to the anti­bonding orbital of the C—Cl bond to stabilize the gauche conformation [Cl—C—C—C = −68.6 (6)°], as confirmed by DFT geo...

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Detalles Bibliográficos
Autores principales: Bond, Marcus R., Silwal, Sajan
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2023
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9912320/
https://www.ncbi.nlm.nih.gov/pubmed/36794055
http://dx.doi.org/10.1107/S2414314623000159