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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...

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Autores principales: Reiss, Guido J., Boldog, Ishtvan, Janiak, Christoph
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2011
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.
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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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