4-(1H-Pyrazol-3-yl)pyridine–terephthalic acid–water (2/1/2)
In the title compound, 2C8H7N3·C8H6O4·2H2O, the pyridine and pyrazole rings are approximately coplanar, the dihedral angle between them being 4.69 (9)°. The asymmetric unit consists of half of the terephthalic acid (an inversion centre generates t...
| Main Authors: | , , , |
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| Format: | Article |
| Language: | English |
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International Union of Crystallography
2012-06-01
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| Series: | Acta Crystallographica Section E |
| Online Access: | http://scripts.iucr.org/cgi-bin/paper?S1600536812021599 |
| _version_ | 1818975519956271104 |
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| author | Zheng-De Tan Feng-Jiao Tan Bo Tan Cheng-Ming Zhang |
| author_facet | Zheng-De Tan Feng-Jiao Tan Bo Tan Cheng-Ming Zhang |
| author_sort | Zheng-De Tan |
| collection | DOAJ |
| description | In the title compound, 2C8H7N3·C8H6O4·2H2O, the pyridine and pyrazole rings are approximately coplanar, the dihedral angle between them being 4.69 (9)°. The asymmetric unit consists of half of the terephthalic acid (an inversion centre generates the other half of the molecule), one 4-(1H-pyrazol-3-yl)pyridine (4pp) molecule and one water molecule. In the crystal, two 4pp and one terephthalic acid molecules form a linear three-molecule unit as a result of O—H...N hydrogen bonds. These units are further assembled into a three-dimensional network by two types of hydrogen bonds, viz. O—H...O and N—H...O. |
| first_indexed | 2024-12-20T15:57:15Z |
| format | Article |
| id | doaj.art-3468b1fb8c5844c2a40a22e232b68094 |
| institution | Directory Open Access Journal |
| issn | 1600-5368 |
| language | English |
| last_indexed | 2024-12-20T15:57:15Z |
| publishDate | 2012-06-01 |
| publisher | International Union of Crystallography |
| record_format | Article |
| series | Acta Crystallographica Section E |
| spelling | doaj.art-3468b1fb8c5844c2a40a22e232b680942022-12-21T19:34:26ZengInternational Union of CrystallographyActa Crystallographica Section E1600-53682012-06-01686o1942o194210.1107/S16005368120215994-(1H-Pyrazol-3-yl)pyridine–terephthalic acid–water (2/1/2)Zheng-De TanFeng-Jiao TanBo TanCheng-Ming ZhangIn the title compound, 2C8H7N3·C8H6O4·2H2O, the pyridine and pyrazole rings are approximately coplanar, the dihedral angle between them being 4.69 (9)°. The asymmetric unit consists of half of the terephthalic acid (an inversion centre generates the other half of the molecule), one 4-(1H-pyrazol-3-yl)pyridine (4pp) molecule and one water molecule. In the crystal, two 4pp and one terephthalic acid molecules form a linear three-molecule unit as a result of O—H...N hydrogen bonds. These units are further assembled into a three-dimensional network by two types of hydrogen bonds, viz. O—H...O and N—H...O.http://scripts.iucr.org/cgi-bin/paper?S1600536812021599 |
| spellingShingle | Zheng-De Tan Feng-Jiao Tan Bo Tan Cheng-Ming Zhang 4-(1H-Pyrazol-3-yl)pyridine–terephthalic acid–water (2/1/2) Acta Crystallographica Section E |
| title | 4-(1H-Pyrazol-3-yl)pyridine–terephthalic acid–water (2/1/2) |
| title_full | 4-(1H-Pyrazol-3-yl)pyridine–terephthalic acid–water (2/1/2) |
| title_fullStr | 4-(1H-Pyrazol-3-yl)pyridine–terephthalic acid–water (2/1/2) |
| title_full_unstemmed | 4-(1H-Pyrazol-3-yl)pyridine–terephthalic acid–water (2/1/2) |
| title_short | 4-(1H-Pyrazol-3-yl)pyridine–terephthalic acid–water (2/1/2) |
| title_sort | 4 1h pyrazol 3 yl pyridine amp 8211 terephthalic acid amp 8211 water 2 1 2 |
| url | http://scripts.iucr.org/cgi-bin/paper?S1600536812021599 |
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