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Redetermination of diaquatetrakis(dimethylformamide-κO)magnesium dichloride
The crystal structure of the title compound, [Mg(C(3)H(7)NO)(4)(H(2)O)(2)]Cl(2), in which the Mg ion lies on a crystallographic inversion centre, confirms that of the previous room-temperature study [Pavanello et al. (1995 ▶). Main Group Met. Chem. 18, 9–19]. This redetermination at 113 K has improv...
Autores principales: | , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2011
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3212177/ https://www.ncbi.nlm.nih.gov/pubmed/22090879 http://dx.doi.org/10.1107/S1600536811027073 |
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author | Reiss, Guido J. Boldog, Ishtvan Janiak, Christoph |
author_facet | Reiss, Guido J. Boldog, Ishtvan Janiak, Christoph |
author_sort | Reiss, Guido J. |
collection | PubMed |
description | The crystal structure of the title compound, [Mg(C(3)H(7)NO)(4)(H(2)O)(2)]Cl(2), in which the Mg ion lies on a crystallographic inversion centre, confirms that of the previous room-temperature study [Pavanello et al. (1995 ▶). Main Group Met. Chem. 18, 9–19]. This redetermination at 113 K has improved geometry precision by almost an order of magnitude [e.g. Mg—O(w) (w = water) distances = 2.094 (4) and 2.0899 (7) Å in the old and new structures, respectively] and allowed the water H atoms to be located and their positions refined. In the crystal, O—H⋯Cl hydrogen bonds between the two aqua ligands of the complex molecule and neighboring chloride counter-anions generate supramolecular chains propagating along [010]. The dicationic [Mg(DMF)(4)(H(2)O)(2)] unit (DMF is dimethylformamide) adopts a slightly distorted octahedral geometry in which the Mg atom is coordinated by four DMF O atoms in a pseudo-tetragonal arrangement and two trans aqua ligands. |
format | Online Article Text |
id | pubmed-3212177 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2011 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-32121772011-11-16 Redetermination of diaquatetrakis(dimethylformamide-κO)magnesium dichloride Reiss, Guido J. Boldog, Ishtvan Janiak, Christoph Acta Crystallogr Sect E Struct Rep Online Metal-Organic Papers The crystal structure of the title compound, [Mg(C(3)H(7)NO)(4)(H(2)O)(2)]Cl(2), in which the Mg ion lies on a crystallographic inversion centre, confirms that of the previous room-temperature study [Pavanello et al. (1995 ▶). Main Group Met. Chem. 18, 9–19]. This redetermination at 113 K has improved geometry precision by almost an order of magnitude [e.g. Mg—O(w) (w = water) distances = 2.094 (4) and 2.0899 (7) Å in the old and new structures, respectively] and allowed the water H atoms to be located and their positions refined. In the crystal, O—H⋯Cl hydrogen bonds between the two aqua ligands of the complex molecule and neighboring chloride counter-anions generate supramolecular chains propagating along [010]. The dicationic [Mg(DMF)(4)(H(2)O)(2)] unit (DMF is dimethylformamide) adopts a slightly distorted octahedral geometry in which the Mg atom is coordinated by four DMF O atoms in a pseudo-tetragonal arrangement and two trans aqua ligands. International Union of Crystallography 2011-07-23 /pmc/articles/PMC3212177/ /pubmed/22090879 http://dx.doi.org/10.1107/S1600536811027073 Text en © Reiss et al. 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 Reiss, Guido J. Boldog, Ishtvan Janiak, Christoph Redetermination of diaquatetrakis(dimethylformamide-κO)magnesium dichloride |
title | Redetermination of diaquatetrakis(dimethylformamide-κO)magnesium dichloride |
title_full | Redetermination of diaquatetrakis(dimethylformamide-κO)magnesium dichloride |
title_fullStr | Redetermination of diaquatetrakis(dimethylformamide-κO)magnesium dichloride |
title_full_unstemmed | Redetermination of diaquatetrakis(dimethylformamide-κO)magnesium dichloride |
title_short | Redetermination of diaquatetrakis(dimethylformamide-κO)magnesium dichloride |
title_sort | redetermination of diaquatetrakis(dimethylformamide-κo)magnesium dichloride |
topic | Metal-Organic Papers |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3212177/ https://www.ncbi.nlm.nih.gov/pubmed/22090879 http://dx.doi.org/10.1107/S1600536811027073 |
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