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Tetra­kis(2,4,6-triamino-1,3,5-triazin-1-ium) tris­(pyridine-2,6-dicarboxyl­ato)calcate(II) hexa­hydrate

The title compound, (C(3)H(7)N(6))(4)[Ca(C(7)H(3)NO(4))(3)]·6H(2)O or (tataH)(4)[Ca(pydc)(3)]·6H(2)O (where tata is 2,4,6-triamino-1,3,5-triazine and pydcH(2) is pyridine-2,6-dicarboxylic acid), was obtained by reaction of Ca(NO(3))(2)·4H(2)O with the proton-transfer compound (tataH)(2)(pydc) in aqu...

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Autores principales: Aghabozorg, Hossein, Daneshvar, Shirin, Nemati, Andya
Formato: Texto
Lenguaje:English
Publicado: International Union of Crystallography 2008
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2961976/
https://www.ncbi.nlm.nih.gov/pubmed/21203046
http://dx.doi.org/10.1107/S1600536808022873
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author Aghabozorg, Hossein
Daneshvar, Shirin
Nemati, Andya
author_facet Aghabozorg, Hossein
Daneshvar, Shirin
Nemati, Andya
author_sort Aghabozorg, Hossein
collection PubMed
description The title compound, (C(3)H(7)N(6))(4)[Ca(C(7)H(3)NO(4))(3)]·6H(2)O or (tataH)(4)[Ca(pydc)(3)]·6H(2)O (where tata is 2,4,6-triamino-1,3,5-triazine and pydcH(2) is pyridine-2,6-dicarboxylic acid), was obtained by reaction of Ca(NO(3))(2)·4H(2)O with the proton-transfer compound (tataH)(2)(pydc) in aqueous solution. The [Ca(pydc)(3)](4−) anion has twofold crystallographic symmetry. It is a nine-coordinate Ca(II) complex with a distorted tricapped trigonal-prismatic coordination geometry. The structure also contains four tataH(+) cations and six uncoordinated water mol­ecules. There are extensive O—H⋯O, O—H⋯N, N—H⋯O, N—H⋯N and C—H⋯O hydrogen bonds in the crystal structure.
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spelling pubmed-29619762010-12-30 Tetra­kis(2,4,6-triamino-1,3,5-triazin-1-ium) tris­(pyridine-2,6-dicarboxyl­ato)calcate(II) hexa­hydrate Aghabozorg, Hossein Daneshvar, Shirin Nemati, Andya Acta Crystallogr Sect E Struct Rep Online Metal-Organic Papers The title compound, (C(3)H(7)N(6))(4)[Ca(C(7)H(3)NO(4))(3)]·6H(2)O or (tataH)(4)[Ca(pydc)(3)]·6H(2)O (where tata is 2,4,6-triamino-1,3,5-triazine and pydcH(2) is pyridine-2,6-dicarboxylic acid), was obtained by reaction of Ca(NO(3))(2)·4H(2)O with the proton-transfer compound (tataH)(2)(pydc) in aqueous solution. The [Ca(pydc)(3)](4−) anion has twofold crystallographic symmetry. It is a nine-coordinate Ca(II) complex with a distorted tricapped trigonal-prismatic coordination geometry. The structure also contains four tataH(+) cations and six uncoordinated water mol­ecules. There are extensive O—H⋯O, O—H⋯N, N—H⋯O, N—H⋯N and C—H⋯O hydrogen bonds in the crystal structure. International Union of Crystallography 2008-07-26 /pmc/articles/PMC2961976/ /pubmed/21203046 http://dx.doi.org/10.1107/S1600536808022873 Text en © Aghabozorg et al. 2008 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
Aghabozorg, Hossein
Daneshvar, Shirin
Nemati, Andya
Tetra­kis(2,4,6-triamino-1,3,5-triazin-1-ium) tris­(pyridine-2,6-dicarboxyl­ato)calcate(II) hexa­hydrate
title Tetra­kis(2,4,6-triamino-1,3,5-triazin-1-ium) tris­(pyridine-2,6-dicarboxyl­ato)calcate(II) hexa­hydrate
title_full Tetra­kis(2,4,6-triamino-1,3,5-triazin-1-ium) tris­(pyridine-2,6-dicarboxyl­ato)calcate(II) hexa­hydrate
title_fullStr Tetra­kis(2,4,6-triamino-1,3,5-triazin-1-ium) tris­(pyridine-2,6-dicarboxyl­ato)calcate(II) hexa­hydrate
title_full_unstemmed Tetra­kis(2,4,6-triamino-1,3,5-triazin-1-ium) tris­(pyridine-2,6-dicarboxyl­ato)calcate(II) hexa­hydrate
title_short Tetra­kis(2,4,6-triamino-1,3,5-triazin-1-ium) tris­(pyridine-2,6-dicarboxyl­ato)calcate(II) hexa­hydrate
title_sort tetra­kis(2,4,6-triamino-1,3,5-triazin-1-ium) tris­(pyridine-2,6-dicarboxyl­ato)calcate(ii) hexa­hydrate
topic Metal-Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2961976/
https://www.ncbi.nlm.nih.gov/pubmed/21203046
http://dx.doi.org/10.1107/S1600536808022873
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