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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...
Autores principales: | , , , , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2012
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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. |
format | Online Article Text |
id | pubmed-3470372 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2012 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
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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