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Calcium disodium hexa­thio­diphosphate(IV) octa­hydrate

Single crystals of the title compound, CaNa(2)(P(2)S(6))·8H(2)O, were obtained by adding calcium hydroxide to an aqueous solution of Na(4)(P(2)S(6))·6H(2)O. The structure is isotypic with that of its strontium analogue and consists of one Ca(2+) cation, two Na(+) cations, one-half of a centrosymmetr...

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Autores principales: Ehrhardt, Claus, Gjikaj, Mimoza
Formato: Texto
Lenguaje:English
Publicado: International Union of Crystallography 2010
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3007360/
https://www.ncbi.nlm.nih.gov/pubmed/21588077
http://dx.doi.org/10.1107/S1600536810025304
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author Ehrhardt, Claus
Gjikaj, Mimoza
author_facet Ehrhardt, Claus
Gjikaj, Mimoza
author_sort Ehrhardt, Claus
collection PubMed
description Single crystals of the title compound, CaNa(2)(P(2)S(6))·8H(2)O, were obtained by adding calcium hydroxide to an aqueous solution of Na(4)(P(2)S(6))·6H(2)O. The structure is isotypic with that of its strontium analogue and consists of one Ca(2+) cation, two Na(+) cations, one-half of a centrosymmetric (P(2)S(6))(4−) anion with staggered confirmation and four water mol­ecules in the asymmetric unit. The crystal structure can be described as being built up from layers of cations and anions extending parallel to (101). Within a layer, each CaO(8) polyhedron is connected via edge-sharing to two NaO(4)S(2) octa­hedra and to one NaO(2)S(4) octa­edron. The NaO(4)S(2) octa­hedra are, in turn, linked with two (P(2)S(6))(4−) anions through common corners. Various O—H⋯S hydrogen-bonding inter­actions lead to cohesion of adjacent layers. The Ca(2+) and one Na(+) cation are situated on a twofold rotation axis and the second Na(+) cation is situated on an inversion centre.
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spelling pubmed-30073602010-12-30 Calcium disodium hexa­thio­diphosphate(IV) octa­hydrate Ehrhardt, Claus Gjikaj, Mimoza Acta Crystallogr Sect E Struct Rep Online Inorganic Papers Single crystals of the title compound, CaNa(2)(P(2)S(6))·8H(2)O, were obtained by adding calcium hydroxide to an aqueous solution of Na(4)(P(2)S(6))·6H(2)O. The structure is isotypic with that of its strontium analogue and consists of one Ca(2+) cation, two Na(+) cations, one-half of a centrosymmetric (P(2)S(6))(4−) anion with staggered confirmation and four water mol­ecules in the asymmetric unit. The crystal structure can be described as being built up from layers of cations and anions extending parallel to (101). Within a layer, each CaO(8) polyhedron is connected via edge-sharing to two NaO(4)S(2) octa­hedra and to one NaO(2)S(4) octa­edron. The NaO(4)S(2) octa­hedra are, in turn, linked with two (P(2)S(6))(4−) anions through common corners. Various O—H⋯S hydrogen-bonding inter­actions lead to cohesion of adjacent layers. The Ca(2+) and one Na(+) cation are situated on a twofold rotation axis and the second Na(+) cation is situated on an inversion centre. International Union of Crystallography 2010-07-03 /pmc/articles/PMC3007360/ /pubmed/21588077 http://dx.doi.org/10.1107/S1600536810025304 Text en © Ehrhardt and Gjikaj 2010 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 Inorganic Papers
Ehrhardt, Claus
Gjikaj, Mimoza
Calcium disodium hexa­thio­diphosphate(IV) octa­hydrate
title Calcium disodium hexa­thio­diphosphate(IV) octa­hydrate
title_full Calcium disodium hexa­thio­diphosphate(IV) octa­hydrate
title_fullStr Calcium disodium hexa­thio­diphosphate(IV) octa­hydrate
title_full_unstemmed Calcium disodium hexa­thio­diphosphate(IV) octa­hydrate
title_short Calcium disodium hexa­thio­diphosphate(IV) octa­hydrate
title_sort calcium disodium hexa­thio­diphosphate(iv) octa­hydrate
topic Inorganic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3007360/
https://www.ncbi.nlm.nih.gov/pubmed/21588077
http://dx.doi.org/10.1107/S1600536810025304
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