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4-(4-Pyrid­yl)pyridinium 3′,4,4′-tricarboxy­biphenyl-3-carboxyl­ate dihydrate

In the title compound, C(10)H(9)N(2) (+)·C(16)H(9)O(8) (−)·2H(2)O, both the cation and anion possess crystallographically imposed centres of symmetry, causing the nitro­gen-bound H atom in the 4-(4-pyrid­yl)pyridinium cation and the acidic H atom of the carboxyl­ate groups at the 3 and 3′ positions...

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Autores principales: Han, Lu, Luo, Huan-Mian, Meng, Qiu-Hui, Luo, Yi-Fan, Zeng, Rong-Hua
Formato: Texto
Lenguaje:English
Publicado: International Union of Crystallography 2009
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2980244/
https://www.ncbi.nlm.nih.gov/pubmed/21580169
http://dx.doi.org/10.1107/S1600536809050831
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author Han, Lu
Luo, Huan-Mian
Meng, Qiu-Hui
Luo, Yi-Fan
Zeng, Rong-Hua
author_facet Han, Lu
Luo, Huan-Mian
Meng, Qiu-Hui
Luo, Yi-Fan
Zeng, Rong-Hua
author_sort Han, Lu
collection PubMed
description In the title compound, C(10)H(9)N(2) (+)·C(16)H(9)O(8) (−)·2H(2)O, both the cation and anion possess crystallographically imposed centres of symmetry, causing the nitro­gen-bound H atom in the 4-(4-pyrid­yl)pyridinium cation and the acidic H atom of the carboxyl­ate groups at the 3 and 3′ positions in the anion to be disordered over two positions with equal occupancies. In the crystal packing, the cations, anions and water mol­ecules are connected by O—H⋯O, C—H⋯O and N—H⋯N hydrogen bonds, forming layers parallel to (2[Image: see text]0). These layer are further connected into a three-dimensional supra­molecular network by O—H⋯O hydrogen bonds involving the water mol­ecules as H-atom donors and by weak π–π stacking inter­actions between neighbouring benzene and pyridine rings, with centroid–centroid distances of 3.756 (5) Å.
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spelling pubmed-29802442010-12-30 4-(4-Pyrid­yl)pyridinium 3′,4,4′-tricarboxy­biphenyl-3-carboxyl­ate dihydrate Han, Lu Luo, Huan-Mian Meng, Qiu-Hui Luo, Yi-Fan Zeng, Rong-Hua Acta Crystallogr Sect E Struct Rep Online Organic Papers In the title compound, C(10)H(9)N(2) (+)·C(16)H(9)O(8) (−)·2H(2)O, both the cation and anion possess crystallographically imposed centres of symmetry, causing the nitro­gen-bound H atom in the 4-(4-pyrid­yl)pyridinium cation and the acidic H atom of the carboxyl­ate groups at the 3 and 3′ positions in the anion to be disordered over two positions with equal occupancies. In the crystal packing, the cations, anions and water mol­ecules are connected by O—H⋯O, C—H⋯O and N—H⋯N hydrogen bonds, forming layers parallel to (2[Image: see text]0). These layer are further connected into a three-dimensional supra­molecular network by O—H⋯O hydrogen bonds involving the water mol­ecules as H-atom donors and by weak π–π stacking inter­actions between neighbouring benzene and pyridine rings, with centroid–centroid distances of 3.756 (5) Å. International Union of Crystallography 2009-12-09 /pmc/articles/PMC2980244/ /pubmed/21580169 http://dx.doi.org/10.1107/S1600536809050831 Text en © Han et al. 2010 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
Han, Lu
Luo, Huan-Mian
Meng, Qiu-Hui
Luo, Yi-Fan
Zeng, Rong-Hua
4-(4-Pyrid­yl)pyridinium 3′,4,4′-tricarboxy­biphenyl-3-carboxyl­ate dihydrate
title 4-(4-Pyrid­yl)pyridinium 3′,4,4′-tricarboxy­biphenyl-3-carboxyl­ate dihydrate
title_full 4-(4-Pyrid­yl)pyridinium 3′,4,4′-tricarboxy­biphenyl-3-carboxyl­ate dihydrate
title_fullStr 4-(4-Pyrid­yl)pyridinium 3′,4,4′-tricarboxy­biphenyl-3-carboxyl­ate dihydrate
title_full_unstemmed 4-(4-Pyrid­yl)pyridinium 3′,4,4′-tricarboxy­biphenyl-3-carboxyl­ate dihydrate
title_short 4-(4-Pyrid­yl)pyridinium 3′,4,4′-tricarboxy­biphenyl-3-carboxyl­ate dihydrate
title_sort 4-(4-pyrid­yl)pyridinium 3′,4,4′-tricarboxy­biphenyl-3-carboxyl­ate dihydrate
topic Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2980244/
https://www.ncbi.nlm.nih.gov/pubmed/21580169
http://dx.doi.org/10.1107/S1600536809050831
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