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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...

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Autores principales: Soudani, Sarra, Aubert, Emmanuel, Wenger, Emmanuel, Jelsch, Christian, Gautier-Luneau, Isabelle, Ben Nasr, Cherif
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2014
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.
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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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