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Poly[diaquatris(μ(6)-4,6-dioxo-1,4,5,6-tetrahydro-1,3,5-triazine-2-carboxylato)tripotassium]
The asymmetric unit of the title compound, [K(3)(C(4)H(2)N(3)O(4))(3)(H(2)O)(2)](n), contains two potassium cations (one in general position, one located on a twofold rotation axis), one and a half oxonate anions (the other half generated by twofold symmetry) and one water molecule. As a result of...
Autores principales: | , , , , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2014
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4011208/ https://www.ncbi.nlm.nih.gov/pubmed/24860308 http://dx.doi.org/10.1107/S1600536814007569 |
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author | Soudani, Sarra Aubert, Emmanuel Wenger, Emmanuel Jelsch, Christian Gautier-Luneau, Isabelle Ben Nasr, Cherif |
author_facet | Soudani, Sarra Aubert, Emmanuel Wenger, Emmanuel Jelsch, Christian Gautier-Luneau, Isabelle Ben Nasr, Cherif |
author_sort | Soudani, Sarra |
collection | PubMed |
description | The asymmetric unit of the title compound, [K(3)(C(4)H(2)N(3)O(4))(3)(H(2)O)(2)](n), contains two potassium cations (one in general position, one located on a twofold rotation axis), one and a half oxonate anions (the other half generated by twofold symmetry) and one water molecule. As a result of the twofold symmetry, one H atom of the symmetric anion is statistically occupied. Both potassium cations are surrounded by eight oxygen atoms in the form of distorted polyhedra. Adjacent cations are interconnected by oxygen bridges, generating layers parallel to (100). The aromatic ring system of the oxonate anions link these layers into a network structure. The crystal packing is stabilized by N—H⋯O, O—H⋯O and O—H⋯N hydrogen bonds, three of which are bifurcated. In addition, intermolecular π–π stacking interactions exist between neighboring aromatic rings with a centroid–centroid distance of 3.241 (2) Å. |
format | Online Article Text |
id | pubmed-4011208 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2014 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-40112082014-05-23 Poly[diaquatris(μ(6)-4,6-dioxo-1,4,5,6-tetrahydro-1,3,5-triazine-2-carboxylato)tripotassium] Soudani, Sarra Aubert, Emmanuel Wenger, Emmanuel Jelsch, Christian Gautier-Luneau, Isabelle Ben Nasr, Cherif Acta Crystallogr Sect E Struct Rep Online Metal-Organic Papers The asymmetric unit of the title compound, [K(3)(C(4)H(2)N(3)O(4))(3)(H(2)O)(2)](n), contains two potassium cations (one in general position, one located on a twofold rotation axis), one and a half oxonate anions (the other half generated by twofold symmetry) and one water molecule. As a result of the twofold symmetry, one H atom of the symmetric anion is statistically occupied. Both potassium cations are surrounded by eight oxygen atoms in the form of distorted polyhedra. Adjacent cations are interconnected by oxygen bridges, generating layers parallel to (100). The aromatic ring system of the oxonate anions link these layers into a network structure. The crystal packing is stabilized by N—H⋯O, O—H⋯O and O—H⋯N hydrogen bonds, three of which are bifurcated. In addition, intermolecular π–π stacking interactions exist between neighboring aromatic rings with a centroid–centroid distance of 3.241 (2) Å. International Union of Crystallography 2014-04-09 /pmc/articles/PMC4011208/ /pubmed/24860308 http://dx.doi.org/10.1107/S1600536814007569 Text en © Soudani et al. 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 | Metal-Organic Papers Soudani, Sarra Aubert, Emmanuel Wenger, Emmanuel Jelsch, Christian Gautier-Luneau, Isabelle Ben Nasr, Cherif Poly[diaquatris(μ(6)-4,6-dioxo-1,4,5,6-tetrahydro-1,3,5-triazine-2-carboxylato)tripotassium] |
title | Poly[diaquatris(μ(6)-4,6-dioxo-1,4,5,6-tetrahydro-1,3,5-triazine-2-carboxylato)tripotassium] |
title_full | Poly[diaquatris(μ(6)-4,6-dioxo-1,4,5,6-tetrahydro-1,3,5-triazine-2-carboxylato)tripotassium] |
title_fullStr | Poly[diaquatris(μ(6)-4,6-dioxo-1,4,5,6-tetrahydro-1,3,5-triazine-2-carboxylato)tripotassium] |
title_full_unstemmed | Poly[diaquatris(μ(6)-4,6-dioxo-1,4,5,6-tetrahydro-1,3,5-triazine-2-carboxylato)tripotassium] |
title_short | Poly[diaquatris(μ(6)-4,6-dioxo-1,4,5,6-tetrahydro-1,3,5-triazine-2-carboxylato)tripotassium] |
title_sort | poly[diaquatris(μ(6)-4,6-dioxo-1,4,5,6-tetrahydro-1,3,5-triazine-2-carboxylato)tripotassium] |
topic | Metal-Organic Papers |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4011208/ https://www.ncbi.nlm.nih.gov/pubmed/24860308 http://dx.doi.org/10.1107/S1600536814007569 |
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