2-(1H-Pyrazol-3-yl)pyridinium chloride monohydrate
The title organic salt, C8H8N3+·Cl−·H2O, exhibits a rich hydrogen-bonding network involving all constituent species. The water molecules are engaged in strong O—H...Cl interactions with the chloride anions, two neighboring protonated 2-(1H-pyrazo...
| Main Authors: | , , |
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| Format: | Article |
| Language: | English |
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International Union of Crystallography
2009-08-01
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| Series: | Acta Crystallographica Section E |
| Online Access: | http://scripts.iucr.org/cgi-bin/paper?S1600536809028402 |
| _version_ | 1818282889635168256 |
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| author | Tatiana R. Amarante Isabel S. Gonçalves Filipe A. Almeida Paz |
| author_facet | Tatiana R. Amarante Isabel S. Gonçalves Filipe A. Almeida Paz |
| author_sort | Tatiana R. Amarante |
| collection | DOAJ |
| description | The title organic salt, C8H8N3+·Cl−·H2O, exhibits a rich hydrogen-bonding network involving all constituent species. The water molecules are engaged in strong O—H...Cl interactions with the chloride anions, two neighboring protonated 2-(1H-pyrazol-3-yl)pyridinium species interact via N—H...N bonds with two pyrazole rings. Further, a short and highly directional C—H...O interaction is observed connecting the pyridinium ring to the water molecule of crystallization. Weak C—H...Cl and N—H...Cl interactions contribute to the stabilization of the crystal structure. |
| first_indexed | 2024-12-13T00:28:11Z |
| format | Article |
| id | doaj.art-8eb41d53a60a4710a34e636fd1c5a51a |
| institution | Directory Open Access Journal |
| issn | 1600-5368 |
| language | English |
| last_indexed | 2024-12-13T00:28:11Z |
| publishDate | 2009-08-01 |
| publisher | International Union of Crystallography |
| record_format | Article |
| series | Acta Crystallographica Section E |
| spelling | doaj.art-8eb41d53a60a4710a34e636fd1c5a51a2022-12-22T00:05:23ZengInternational Union of CrystallographyActa Crystallographica Section E1600-53682009-08-01658o1962o196310.1107/S16005368090284022-(1H-Pyrazol-3-yl)pyridinium chloride monohydrateTatiana R. AmaranteIsabel S. GonçalvesFilipe A. Almeida PazThe title organic salt, C8H8N3+·Cl−·H2O, exhibits a rich hydrogen-bonding network involving all constituent species. The water molecules are engaged in strong O—H...Cl interactions with the chloride anions, two neighboring protonated 2-(1H-pyrazol-3-yl)pyridinium species interact via N—H...N bonds with two pyrazole rings. Further, a short and highly directional C—H...O interaction is observed connecting the pyridinium ring to the water molecule of crystallization. Weak C—H...Cl and N—H...Cl interactions contribute to the stabilization of the crystal structure.http://scripts.iucr.org/cgi-bin/paper?S1600536809028402 |
| spellingShingle | Tatiana R. Amarante Isabel S. Gonçalves Filipe A. Almeida Paz 2-(1H-Pyrazol-3-yl)pyridinium chloride monohydrate Acta Crystallographica Section E |
| title | 2-(1H-Pyrazol-3-yl)pyridinium chloride monohydrate |
| title_full | 2-(1H-Pyrazol-3-yl)pyridinium chloride monohydrate |
| title_fullStr | 2-(1H-Pyrazol-3-yl)pyridinium chloride monohydrate |
| title_full_unstemmed | 2-(1H-Pyrazol-3-yl)pyridinium chloride monohydrate |
| title_short | 2-(1H-Pyrazol-3-yl)pyridinium chloride monohydrate |
| title_sort | 2 1h pyrazol 3 yl pyridinium chloride monohydrate |
| url | http://scripts.iucr.org/cgi-bin/paper?S1600536809028402 |
| work_keys_str_mv | AT tatianaramarante 21hpyrazol3ylpyridiniumchloridemonohydrate AT isabelsgonamp231alves 21hpyrazol3ylpyridiniumchloridemonohydrate AT filipeaalmeidapaz 21hpyrazol3ylpyridiniumchloridemonohydrate |