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Crystal structure of magnesium selenate heptahydrate, MgSeO(4)·7H(2)O, from neutron time-of-flight data
MgSeO(4)·7H(2)O is isostructural with the analogous sulfate, MgSO(4)·7H(2)O, consisting of isolated [Mg(H(2)O)(6)](2+) octahedra and [SeO(4)](2−) tetrahedra, linked by O—H⋯O hydrogen bonds, with a single interstitial lattice water molecule. As in the sulfate, the [Mg(H(2)O)(6)](2+) coordination...
Autores principales: | , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
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International Union of Crystallography
2014
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Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4186159/ https://www.ncbi.nlm.nih.gov/pubmed/25309161 http://dx.doi.org/10.1107/S1600536814018698 |
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author | Fortes, A. Dominic Gutmann, Matthias J. |
author_facet | Fortes, A. Dominic Gutmann, Matthias J. |
author_sort | Fortes, A. Dominic |
collection | PubMed |
description | MgSeO(4)·7H(2)O is isostructural with the analogous sulfate, MgSO(4)·7H(2)O, consisting of isolated [Mg(H(2)O)(6)](2+) octahedra and [SeO(4)](2−) tetrahedra, linked by O—H⋯O hydrogen bonds, with a single interstitial lattice water molecule. As in the sulfate, the [Mg(H(2)O)(6)](2+) coordination octahedron is elongated along one axis due to the tetrahedral coordination of the two apical water molecules; these have Mg—O distances of ∼2.10 Å, whereas the remaining four trigonally coordinated water molecules have Mg—O distances of ∼2.05 Å. The mean Se—O bond length is 1.641 Å and is in excellent agreement with other selenates. The unit-cell volume of MgSeO(4)·7H(2)O at 10 K is 4.1% larger than that of the sulfate at 2 K, although this is not uniform; the greater part of the expansion is along the a axis of the crystal. |
format | Online Article Text |
id | pubmed-4186159 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2014 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-41861592014-10-12 Crystal structure of magnesium selenate heptahydrate, MgSeO(4)·7H(2)O, from neutron time-of-flight data Fortes, A. Dominic Gutmann, Matthias J. Acta Crystallogr Sect E Struct Rep Online Research Communications MgSeO(4)·7H(2)O is isostructural with the analogous sulfate, MgSO(4)·7H(2)O, consisting of isolated [Mg(H(2)O)(6)](2+) octahedra and [SeO(4)](2−) tetrahedra, linked by O—H⋯O hydrogen bonds, with a single interstitial lattice water molecule. As in the sulfate, the [Mg(H(2)O)(6)](2+) coordination octahedron is elongated along one axis due to the tetrahedral coordination of the two apical water molecules; these have Mg—O distances of ∼2.10 Å, whereas the remaining four trigonally coordinated water molecules have Mg—O distances of ∼2.05 Å. The mean Se—O bond length is 1.641 Å and is in excellent agreement with other selenates. The unit-cell volume of MgSeO(4)·7H(2)O at 10 K is 4.1% larger than that of the sulfate at 2 K, although this is not uniform; the greater part of the expansion is along the a axis of the crystal. International Union of Crystallography 2014-08-23 /pmc/articles/PMC4186159/ /pubmed/25309161 http://dx.doi.org/10.1107/S1600536814018698 Text en © Fortes and Gutmann 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 | Research Communications Fortes, A. Dominic Gutmann, Matthias J. Crystal structure of magnesium selenate heptahydrate, MgSeO(4)·7H(2)O, from neutron time-of-flight data |
title | Crystal structure of magnesium selenate heptahydrate, MgSeO(4)·7H(2)O, from neutron time-of-flight data |
title_full | Crystal structure of magnesium selenate heptahydrate, MgSeO(4)·7H(2)O, from neutron time-of-flight data |
title_fullStr | Crystal structure of magnesium selenate heptahydrate, MgSeO(4)·7H(2)O, from neutron time-of-flight data |
title_full_unstemmed | Crystal structure of magnesium selenate heptahydrate, MgSeO(4)·7H(2)O, from neutron time-of-flight data |
title_short | Crystal structure of magnesium selenate heptahydrate, MgSeO(4)·7H(2)O, from neutron time-of-flight data |
title_sort | crystal structure of magnesium selenate heptahydrate, mgseo(4)·7h(2)o, from neutron time-of-flight data |
topic | Research Communications |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4186159/ https://www.ncbi.nlm.nih.gov/pubmed/25309161 http://dx.doi.org/10.1107/S1600536814018698 |
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