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Tetra­methyl­ammonium hydrogen terephthalate

The asymmetric unit of the title salt, C(4)H(12)N(+)·C(8)H(5)O(4) (−), contains one half of a tetra­methyl­ammonium cation and one half of a hydrogen terephthalate monoanion. The N atom of the ammonium cation lies on a twofold rotation axis and the centre of mass of the terephthalate anion is on a c...

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Autores principales: Dolatyari, Leila, Shoghpour Bayraq, Samad, Sharifi, Sara, Ramazani, Ali, Morsali, Ali, Amiri Rudbari, Hadi
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2012
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3470372/
https://www.ncbi.nlm.nih.gov/pubmed/23125785
http://dx.doi.org/10.1107/S1600536812039487
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author Dolatyari, Leila
Shoghpour Bayraq, Samad
Sharifi, Sara
Ramazani, Ali
Morsali, Ali
Amiri Rudbari, Hadi
author_facet Dolatyari, Leila
Shoghpour Bayraq, Samad
Sharifi, Sara
Ramazani, Ali
Morsali, Ali
Amiri Rudbari, Hadi
author_sort Dolatyari, Leila
collection PubMed
description The asymmetric unit of the title salt, C(4)H(12)N(+)·C(8)H(5)O(4) (−), contains one half of a tetra­methyl­ammonium cation and one half of a hydrogen terephthalate monoanion. The N atom of the ammonium cation lies on a twofold rotation axis and the centre of mass of the terephthalate anion is on a centre of inversion. In the crystal, the centrosymmetric terephthalate ions are linked by a very short symmetric O—H⋯O hydrogen bond [O⋯O = 2.4610 (19) Å] into a one-dimensional polymeric chain along [1-12]. The tetra­methyl­ammonium cations and terephthalate anions are then connected through a pair of bifurcated acceptor C—H⋯O hydrogen bonds, generating a three-dimensional supra­molecular network. The carboxyl­ate groups at both ends of the terephthalate anion are charge-shared with an equal probability of 0.5.
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spelling pubmed-34703722012-11-02 Tetra­methyl­ammonium hydrogen terephthalate Dolatyari, Leila Shoghpour Bayraq, Samad Sharifi, Sara Ramazani, Ali Morsali, Ali Amiri Rudbari, Hadi Acta Crystallogr Sect E Struct Rep Online Organic Papers The asymmetric unit of the title salt, C(4)H(12)N(+)·C(8)H(5)O(4) (−), contains one half of a tetra­methyl­ammonium cation and one half of a hydrogen terephthalate monoanion. The N atom of the ammonium cation lies on a twofold rotation axis and the centre of mass of the terephthalate anion is on a centre of inversion. In the crystal, the centrosymmetric terephthalate ions are linked by a very short symmetric O—H⋯O hydrogen bond [O⋯O = 2.4610 (19) Å] into a one-dimensional polymeric chain along [1-12]. The tetra­methyl­ammonium cations and terephthalate anions are then connected through a pair of bifurcated acceptor C—H⋯O hydrogen bonds, generating a three-dimensional supra­molecular network. The carboxyl­ate groups at both ends of the terephthalate anion are charge-shared with an equal probability of 0.5. International Union of Crystallography 2012-09-26 /pmc/articles/PMC3470372/ /pubmed/23125785 http://dx.doi.org/10.1107/S1600536812039487 Text en © Dolatyari et al. 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
Dolatyari, Leila
Shoghpour Bayraq, Samad
Sharifi, Sara
Ramazani, Ali
Morsali, Ali
Amiri Rudbari, Hadi
Tetra­methyl­ammonium hydrogen terephthalate
title Tetra­methyl­ammonium hydrogen terephthalate
title_full Tetra­methyl­ammonium hydrogen terephthalate
title_fullStr Tetra­methyl­ammonium hydrogen terephthalate
title_full_unstemmed Tetra­methyl­ammonium hydrogen terephthalate
title_short Tetra­methyl­ammonium hydrogen terephthalate
title_sort tetra­methyl­ammonium hydrogen terephthalate
topic Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3470372/
https://www.ncbi.nlm.nih.gov/pubmed/23125785
http://dx.doi.org/10.1107/S1600536812039487
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AT ramazaniali tetramethylammoniumhydrogenterephthalate
AT morsaliali tetramethylammoniumhydrogenterephthalate
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