Cargando…
5-(Pyridinium-3-yl)tetrazol-1-ide hexaaquamagnesium dichloride
In the title compound, (C(6)H(5)N(5))(2)[Mg(H(2)O)(6)]Cl(2), the asymmetric unit contains one zwitterionic 5-(pyridinium-3-yl)tetrazol-1-ide molecule, one half of an [Mg(H(2)O)(6)](2+) cation ([Image: see text] symmetry) and one chloride ion. The Mg(II) ion is surrounded by six water molecules, w...
Autores principales: | , |
---|---|
Formato: | Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2011
|
Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3051589/ https://www.ncbi.nlm.nih.gov/pubmed/21522848 http://dx.doi.org/10.1107/S160053681005419X |
_version_ | 1782199514974650368 |
---|---|
author | Dai, Jing Chen, Xin-Yuan |
author_facet | Dai, Jing Chen, Xin-Yuan |
author_sort | Dai, Jing |
collection | PubMed |
description | In the title compound, (C(6)H(5)N(5))(2)[Mg(H(2)O)(6)]Cl(2), the asymmetric unit contains one zwitterionic 5-(pyridinium-3-yl)tetrazol-1-ide molecule, one half of an [Mg(H(2)O)(6)](2+) cation ([Image: see text] symmetry) and one chloride ion. The Mg(II) ion is surrounded by six water molecules, with their O atoms located at the apices, exhibiting a slightly distorted octahedral coordination. Mg—O bond lengths range from 2.0526 (14) to 2.0965 (16) Å [mean value = 2.068 Å]. The pyridine and tetrazole rings are nearly coplanar and only twisted from each other by a dihedral angle of 5.68 (1)°. The zwitterionic organic molecules, anions and cations are connected by O—H⋯Cl, O—H⋯N and N—H⋯Cl hydrogen bonds, leading to the formation of a three-dimensional network. |
format | Text |
id | pubmed-3051589 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2011 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-30515892011-04-26 5-(Pyridinium-3-yl)tetrazol-1-ide hexaaquamagnesium dichloride Dai, Jing Chen, Xin-Yuan Acta Crystallogr Sect E Struct Rep Online Metal-Organic Papers In the title compound, (C(6)H(5)N(5))(2)[Mg(H(2)O)(6)]Cl(2), the asymmetric unit contains one zwitterionic 5-(pyridinium-3-yl)tetrazol-1-ide molecule, one half of an [Mg(H(2)O)(6)](2+) cation ([Image: see text] symmetry) and one chloride ion. The Mg(II) ion is surrounded by six water molecules, with their O atoms located at the apices, exhibiting a slightly distorted octahedral coordination. Mg—O bond lengths range from 2.0526 (14) to 2.0965 (16) Å [mean value = 2.068 Å]. The pyridine and tetrazole rings are nearly coplanar and only twisted from each other by a dihedral angle of 5.68 (1)°. The zwitterionic organic molecules, anions and cations are connected by O—H⋯Cl, O—H⋯N and N—H⋯Cl hydrogen bonds, leading to the formation of a three-dimensional network. International Union of Crystallography 2011-01-15 /pmc/articles/PMC3051589/ /pubmed/21522848 http://dx.doi.org/10.1107/S160053681005419X Text en © Dai and Chen 2011 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 | Metal-Organic Papers Dai, Jing Chen, Xin-Yuan 5-(Pyridinium-3-yl)tetrazol-1-ide hexaaquamagnesium dichloride |
title | 5-(Pyridinium-3-yl)tetrazol-1-ide hexaaquamagnesium dichloride |
title_full | 5-(Pyridinium-3-yl)tetrazol-1-ide hexaaquamagnesium dichloride |
title_fullStr | 5-(Pyridinium-3-yl)tetrazol-1-ide hexaaquamagnesium dichloride |
title_full_unstemmed | 5-(Pyridinium-3-yl)tetrazol-1-ide hexaaquamagnesium dichloride |
title_short | 5-(Pyridinium-3-yl)tetrazol-1-ide hexaaquamagnesium dichloride |
title_sort | 5-(pyridinium-3-yl)tetrazol-1-ide hexaaquamagnesium dichloride |
topic | Metal-Organic Papers |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3051589/ https://www.ncbi.nlm.nih.gov/pubmed/21522848 http://dx.doi.org/10.1107/S160053681005419X |
work_keys_str_mv | AT daijing 5pyridinium3yltetrazol1idehexaaquamagnesiumdichloride AT chenxinyuan 5pyridinium3yltetrazol1idehexaaquamagnesiumdichloride |