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Benzene-1,3,5-tricarboxylic acid–pyridinium-2-olate (1/3)
The asymmetric unit of the title compound, C(9)H(6)O(6)·3C(5)H(5)NO, contains one benzene-1,3,5-tricarboxylic acid molecule (BTA) and three pyridin-2-ol molecules each present in the zwitterion form. In the crystal, these entities are linked through O—H⋯O(−) and N(+)—H⋯O(−) hydrogen bonds, form...
Autores principales: | , , , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2014
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3998530/ https://www.ncbi.nlm.nih.gov/pubmed/24826154 http://dx.doi.org/10.1107/S1600536814005534 |
Sumario: | The asymmetric unit of the title compound, C(9)H(6)O(6)·3C(5)H(5)NO, contains one benzene-1,3,5-tricarboxylic acid molecule (BTA) and three pyridin-2-ol molecules each present in the zwitterion form. In the crystal, these entities are linked through O—H⋯O(−) and N(+)—H⋯O(−) hydrogen bonds, forming sheets parallel to (10-1). These layers contain macrocyclic rings of composition [BTA](2)[pyol](6) and with graph-set notation R (6) (8)(44), which are stacked along c through π–π interactions [inter-centroid distances = 3.536 (2)–3.948 (3) Å]. They are interconnected by N(+)—H⋯O(−) hydrogen-bonded chains of pyridin-2-ol molecules running parallel to c, forming a three-dimensional network. There are also C—H⋯O hydrogen bonds present which reinforce the three-dimensional structure. |
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