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Crystal structure of bis­(9H-6-amino­purin-1-ium) hexa­fluorido­silicate(IV) dihydrate

The asymmetric unit of the title compound, 2C(5)H(6)N(5) (+)·SiF(6) (2−)·2H(2)O, contains one adeninium cation, half of a hexa­fluorido­silicate anion located on an inversion centre and one lattice water mol­ecule. The adeninium cations are connected through N—H⋯N hydrogen bonds involving one H atom...

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Autores principales: Belhouas, Ratiba, Bouacida, Sofiane, Boudaren, Chaouki, Daran, Jean-Claude, Chtoun, El Hossain
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2015
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4384624/
https://www.ncbi.nlm.nih.gov/pubmed/25878877
http://dx.doi.org/10.1107/S2056989014027005
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author Belhouas, Ratiba
Bouacida, Sofiane
Boudaren, Chaouki
Daran, Jean-Claude
Chtoun, El Hossain
author_facet Belhouas, Ratiba
Bouacida, Sofiane
Boudaren, Chaouki
Daran, Jean-Claude
Chtoun, El Hossain
author_sort Belhouas, Ratiba
collection PubMed
description The asymmetric unit of the title compound, 2C(5)H(6)N(5) (+)·SiF(6) (2−)·2H(2)O, contains one adeninium cation, half of a hexa­fluorido­silicate anion located on an inversion centre and one lattice water mol­ecule. The adeninium cations are connected through N—H⋯N hydrogen bonds involving one H atom of the –NH(2) group and the H atom of the protonated N atom of the adenine ring system, forming centrosymmetric ring motifs of the type R (2) (2)(10) and R (2) (2)(8), respectively. The overall connection of the cation leads to the formation of planar ribbons parallel to (122). In the ribbons, slipped π–π stacking inter­actions, with a centroid-to-centroid distance of 3.6938 (9) Å, an inter­planar distance of 3.455 Å and a slippage of 1.306 Å is observed. The hexa­fluorido­silicate anion and the water mol­ecule are linked through O—H⋯F hydrogen bonds [ring motif R (4) (4)(12)] into chains parallel to [100]. The cationic ribbons and anionic chains are finally connected through additional N—H⋯O, N—H⋯F and O—H⋯F hydrogen bonds into a three-dimensional network in which layers of adeninium cations and fluorido­silicate anions alternate parallel to (001).
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spelling pubmed-43846242015-04-15 Crystal structure of bis­(9H-6-amino­purin-1-ium) hexa­fluorido­silicate(IV) dihydrate Belhouas, Ratiba Bouacida, Sofiane Boudaren, Chaouki Daran, Jean-Claude Chtoun, El Hossain Acta Crystallogr E Crystallogr Commun Data Reports The asymmetric unit of the title compound, 2C(5)H(6)N(5) (+)·SiF(6) (2−)·2H(2)O, contains one adeninium cation, half of a hexa­fluorido­silicate anion located on an inversion centre and one lattice water mol­ecule. The adeninium cations are connected through N—H⋯N hydrogen bonds involving one H atom of the –NH(2) group and the H atom of the protonated N atom of the adenine ring system, forming centrosymmetric ring motifs of the type R (2) (2)(10) and R (2) (2)(8), respectively. The overall connection of the cation leads to the formation of planar ribbons parallel to (122). In the ribbons, slipped π–π stacking inter­actions, with a centroid-to-centroid distance of 3.6938 (9) Å, an inter­planar distance of 3.455 Å and a slippage of 1.306 Å is observed. The hexa­fluorido­silicate anion and the water mol­ecule are linked through O—H⋯F hydrogen bonds [ring motif R (4) (4)(12)] into chains parallel to [100]. The cationic ribbons and anionic chains are finally connected through additional N—H⋯O, N—H⋯F and O—H⋯F hydrogen bonds into a three-dimensional network in which layers of adeninium cations and fluorido­silicate anions alternate parallel to (001). International Union of Crystallography 2015-01-03 /pmc/articles/PMC4384624/ /pubmed/25878877 http://dx.doi.org/10.1107/S2056989014027005 Text en © Belhouas et al. 2015 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 Data Reports
Belhouas, Ratiba
Bouacida, Sofiane
Boudaren, Chaouki
Daran, Jean-Claude
Chtoun, El Hossain
Crystal structure of bis­(9H-6-amino­purin-1-ium) hexa­fluorido­silicate(IV) dihydrate
title Crystal structure of bis­(9H-6-amino­purin-1-ium) hexa­fluorido­silicate(IV) dihydrate
title_full Crystal structure of bis­(9H-6-amino­purin-1-ium) hexa­fluorido­silicate(IV) dihydrate
title_fullStr Crystal structure of bis­(9H-6-amino­purin-1-ium) hexa­fluorido­silicate(IV) dihydrate
title_full_unstemmed Crystal structure of bis­(9H-6-amino­purin-1-ium) hexa­fluorido­silicate(IV) dihydrate
title_short Crystal structure of bis­(9H-6-amino­purin-1-ium) hexa­fluorido­silicate(IV) dihydrate
title_sort crystal structure of bis­(9h-6-amino­purin-1-ium) hexa­fluorido­silicate(iv) dihydrate
topic Data Reports
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4384624/
https://www.ncbi.nlm.nih.gov/pubmed/25878877
http://dx.doi.org/10.1107/S2056989014027005
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