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Quinolinium 8-hy­droxy-7-iodo­quinoline-5-sulfonate 0.8-hydrate

In the crystal structure of the title hydrated quinolinium salt of ferron (8-hy­droxy-7-iodo­quinoline-5-sulfonic acid), C(9)H(7)N(+)·C(9)H(5)INO(4)S(−)·0.8H(2)O, the quinolinium cation is fully disordered over two sites (occupancy factors fixed at 0.63 and 0.37) lying essentially within a common pl...

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Detalles Bibliográficos
Autor principal: Smith, Graham
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2012
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3588950/
https://www.ncbi.nlm.nih.gov/pubmed/23476186
http://dx.doi.org/10.1107/S1600536812046247
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author Smith, Graham
author_facet Smith, Graham
author_sort Smith, Graham
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description In the crystal structure of the title hydrated quinolinium salt of ferron (8-hy­droxy-7-iodo­quinoline-5-sulfonic acid), C(9)H(7)N(+)·C(9)H(5)INO(4)S(−)·0.8H(2)O, the quinolinium cation is fully disordered over two sites (occupancy factors fixed at 0.63 and 0.37) lying essentially within a common plane and with the ferron anions forming π–π-associated stacks down the b axis [minimum ring centroid separation = 3.462 (6) Å]. The cations and anions are linked into chains extending along c through hy­droxy O—H⋯O and quinolinium N—H⋯O hydrogen bonds to sulfonate O-atom acceptors which are also involved in water O—H⋯O hydrogen-bonding inter­actions along b, giving a two-dimensional network.
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spelling pubmed-35889502013-03-08 Quinolinium 8-hy­droxy-7-iodo­quinoline-5-sulfonate 0.8-hydrate Smith, Graham Acta Crystallogr Sect E Struct Rep Online Organic Papers In the crystal structure of the title hydrated quinolinium salt of ferron (8-hy­droxy-7-iodo­quinoline-5-sulfonic acid), C(9)H(7)N(+)·C(9)H(5)INO(4)S(−)·0.8H(2)O, the quinolinium cation is fully disordered over two sites (occupancy factors fixed at 0.63 and 0.37) lying essentially within a common plane and with the ferron anions forming π–π-associated stacks down the b axis [minimum ring centroid separation = 3.462 (6) Å]. The cations and anions are linked into chains extending along c through hy­droxy O—H⋯O and quinolinium N—H⋯O hydrogen bonds to sulfonate O-atom acceptors which are also involved in water O—H⋯O hydrogen-bonding inter­actions along b, giving a two-dimensional network. International Union of Crystallography 2012-11-14 /pmc/articles/PMC3588950/ /pubmed/23476186 http://dx.doi.org/10.1107/S1600536812046247 Text en © Graham Smith 2012 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 Organic Papers
Smith, Graham
Quinolinium 8-hy­droxy-7-iodo­quinoline-5-sulfonate 0.8-hydrate
title Quinolinium 8-hy­droxy-7-iodo­quinoline-5-sulfonate 0.8-hydrate
title_full Quinolinium 8-hy­droxy-7-iodo­quinoline-5-sulfonate 0.8-hydrate
title_fullStr Quinolinium 8-hy­droxy-7-iodo­quinoline-5-sulfonate 0.8-hydrate
title_full_unstemmed Quinolinium 8-hy­droxy-7-iodo­quinoline-5-sulfonate 0.8-hydrate
title_short Quinolinium 8-hy­droxy-7-iodo­quinoline-5-sulfonate 0.8-hydrate
title_sort quinolinium 8-hy­droxy-7-iodo­quinoline-5-sulfonate 0.8-hydrate
topic Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3588950/
https://www.ncbi.nlm.nih.gov/pubmed/23476186
http://dx.doi.org/10.1107/S1600536812046247
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