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Crystal structure and Hirshfeld surface analysis of trans-2,5-di­methyl­piperazine-1,4-diium tetra­chlorido­cobaltate(II)

In the title mol­ecular salt, (C(6)H(16)N(2))[CoCl(4)], the complete dication is generated by crystallographic inversion symmetry and the piperazine ring adopts a chair conformation with the pendant methyl groups in equatorial orientations. The complete dianion is generated by crystallographic twofo...

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Autores principales: Landolsi, Meriem, Abid, Sonia
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2021
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8025852/
https://www.ncbi.nlm.nih.gov/pubmed/33936770
http://dx.doi.org/10.1107/S2056989021002954
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author Landolsi, Meriem
Abid, Sonia
author_facet Landolsi, Meriem
Abid, Sonia
author_sort Landolsi, Meriem
collection PubMed
description In the title mol­ecular salt, (C(6)H(16)N(2))[CoCl(4)], the complete dication is generated by crystallographic inversion symmetry and the piperazine ring adopts a chair conformation with the pendant methyl groups in equatorial orientations. The complete dianion is generated by crystallographic twofold symmetry. In the crystal, the (C(6)H(16)N(2))(2+) and [CoCl(4)](2−) ions are linked by N—H⋯Cl and C—H⋯Cl hydrogen bonds, thereby forming a two-dimensional supra­molecular network. The Hirshfeld surface analysis and fingerprint plots reveal that the largest contributions to the crystal stability come from H⋯Cl/Cl⋯H (68.4%) and H⋯H (27.4%) contacts.
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spelling pubmed-80258522021-04-30 Crystal structure and Hirshfeld surface analysis of trans-2,5-di­methyl­piperazine-1,4-diium tetra­chlorido­cobaltate(II) Landolsi, Meriem Abid, Sonia Acta Crystallogr E Crystallogr Commun Research Communications In the title mol­ecular salt, (C(6)H(16)N(2))[CoCl(4)], the complete dication is generated by crystallographic inversion symmetry and the piperazine ring adopts a chair conformation with the pendant methyl groups in equatorial orientations. The complete dianion is generated by crystallographic twofold symmetry. In the crystal, the (C(6)H(16)N(2))(2+) and [CoCl(4)](2−) ions are linked by N—H⋯Cl and C—H⋯Cl hydrogen bonds, thereby forming a two-dimensional supra­molecular network. The Hirshfeld surface analysis and fingerprint plots reveal that the largest contributions to the crystal stability come from H⋯Cl/Cl⋯H (68.4%) and H⋯H (27.4%) contacts. International Union of Crystallography 2021-03-26 /pmc/articles/PMC8025852/ /pubmed/33936770 http://dx.doi.org/10.1107/S2056989021002954 Text en © Landolsi and Abid 2021 http://creativecommons.org/licenses/by/4.0/ This is an open-access article distributed under the terms of the Creative Commons Attribution (CC-BY) Licence, which permits unrestricted use, distribution, and reproduction in any medium, provided the original authors and source are cited.http://creativecommons.org/licenses/by/4.0/
spellingShingle Research Communications
Landolsi, Meriem
Abid, Sonia
Crystal structure and Hirshfeld surface analysis of trans-2,5-di­methyl­piperazine-1,4-diium tetra­chlorido­cobaltate(II)
title Crystal structure and Hirshfeld surface analysis of trans-2,5-di­methyl­piperazine-1,4-diium tetra­chlorido­cobaltate(II)
title_full Crystal structure and Hirshfeld surface analysis of trans-2,5-di­methyl­piperazine-1,4-diium tetra­chlorido­cobaltate(II)
title_fullStr Crystal structure and Hirshfeld surface analysis of trans-2,5-di­methyl­piperazine-1,4-diium tetra­chlorido­cobaltate(II)
title_full_unstemmed Crystal structure and Hirshfeld surface analysis of trans-2,5-di­methyl­piperazine-1,4-diium tetra­chlorido­cobaltate(II)
title_short Crystal structure and Hirshfeld surface analysis of trans-2,5-di­methyl­piperazine-1,4-diium tetra­chlorido­cobaltate(II)
title_sort crystal structure and hirshfeld surface analysis of trans-2,5-di­methyl­piperazine-1,4-diium tetra­chlorido­cobaltate(ii)
topic Research Communications
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8025852/
https://www.ncbi.nlm.nih.gov/pubmed/33936770
http://dx.doi.org/10.1107/S2056989021002954
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