Crystal structure of N (1)-benzyl-N (1),N (2),N (2)-tri­methyl­ethane-1,2-diaminium dichloride

In the title mol­ecular salt, C(12)H(22)N(2) (2+)·2Cl(−), which was obtained as a by-product in the attempted synthesis of a mercury derivative, the conformation of the N—C—C—N bond in the cation is anti [torsion angle = 175.1 (10)°]. In the crystal, the cations are linked to the anions by N—H⋯Cl hy...

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Autores principales: Singh, Pushpendra, Singh, Harkesh B., Butcher, Ray J.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2014
Materias:
Data Reports
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4186135/
https://www.ncbi.nlm.nih.gov/pubmed/25309248
http://dx.doi.org/10.1107/S1600536814015797
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author Singh, Pushpendra
Singh, Harkesh B.
Butcher, Ray J.
author_facet Singh, Pushpendra
Singh, Harkesh B.
Butcher, Ray J.
author_sort Singh, Pushpendra
collection PubMed
description In the title mol­ecular salt, C(12)H(22)N(2) (2+)·2Cl(−), which was obtained as a by-product in the attempted synthesis of a mercury derivative, the conformation of the N—C—C—N bond in the cation is anti [torsion angle = 175.1 (10)°]. In the crystal, the cations are linked to the anions by N—H⋯Cl hydrogen bonds, generating ion-triplets. These are linked by numerous weak C—H⋯Cl inter­actions, generating a three-dimensional network. The structure was refined as an inversion twin.
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spelling pubmed-41861352014-10-12 Crystal structure of N (1)-benzyl-N (1),N (2),N (2)-tri­methyl­ethane-1,2-diaminium dichloride Singh, Pushpendra Singh, Harkesh B. Butcher, Ray J. Acta Crystallogr Sect E Struct Rep Online Data Reports In the title mol­ecular salt, C(12)H(22)N(2) (2+)·2Cl(−), which was obtained as a by-product in the attempted synthesis of a mercury derivative, the conformation of the N—C—C—N bond in the cation is anti [torsion angle = 175.1 (10)°]. In the crystal, the cations are linked to the anions by N—H⋯Cl hydrogen bonds, generating ion-triplets. These are linked by numerous weak C—H⋯Cl inter­actions, generating a three-dimensional network. The structure was refined as an inversion twin. International Union of Crystallography 2014-08-01 /pmc/articles/PMC4186135/ /pubmed/25309248 http://dx.doi.org/10.1107/S1600536814015797 Text en © Singh et al. 2014 http://creativecommons.org/licenses/by/2.0/uk/ This is an open-access article distributed under the terms of the Creative Commons Attribution Licence, which permits unrestricted use, distribution, and reproduction in any medium, provided the original authors and source are cited.
spellingShingle Data Reports
Singh, Pushpendra
Singh, Harkesh B.
Butcher, Ray J.
Crystal structure of N (1)-benzyl-N (1),N (2),N (2)-tri­methyl­ethane-1,2-diaminium dichloride
title Crystal structure of N (1)-benzyl-N (1),N (2),N (2)-tri­methyl­ethane-1,2-diaminium dichloride
title_full Crystal structure of N (1)-benzyl-N (1),N (2),N (2)-tri­methyl­ethane-1,2-diaminium dichloride
title_fullStr Crystal structure of N (1)-benzyl-N (1),N (2),N (2)-tri­methyl­ethane-1,2-diaminium dichloride
title_full_unstemmed Crystal structure of N (1)-benzyl-N (1),N (2),N (2)-tri­methyl­ethane-1,2-diaminium dichloride
title_short Crystal structure of N (1)-benzyl-N (1),N (2),N (2)-tri­methyl­ethane-1,2-diaminium dichloride
title_sort crystal structure of n (1)-benzyl-n (1),n (2),n (2)-tri­methyl­ethane-1,2-diaminium dichloride
topic Data Reports
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4186135/
https://www.ncbi.nlm.nih.gov/pubmed/25309248
http://dx.doi.org/10.1107/S1600536814015797
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AT butcherrayj crystalstructureofn1benzyln1n2n2trimethylethane12diaminiumdichloride

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