Dimethylammonium 2-amino-5-nitroterephthalate hemihydrate
The asymmetric unit of the title compound, C2H8N+·C8H5N2O6−·0.5H2O, comprises a monodeprotonated 2-amino-5-nitroterephthalate anion and a dimethylammonium counter-ion on general positions and a water molecule that lies on a twofold rotation axis. Extensive hydrogen bonding is observed between the ca...
| Main Authors: | , , , |
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| Format: | Article |
| Language: | English |
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International Union of Crystallography
2016-01-01
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| Series: | IUCrData |
| Subjects: | |
| Online Access: | http://scripts.iucr.org/cgi-bin/paper?S2414314616000481 |
| _version_ | 1828778049066237952 |
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| author | Martin Krueger Martin Albat Florian Pieper Norbert Stock |
| author_facet | Martin Krueger Martin Albat Florian Pieper Norbert Stock |
| author_sort | Martin Krueger |
| collection | DOAJ |
| description | The asymmetric unit of the title compound, C2H8N+·C8H5N2O6−·0.5H2O, comprises a monodeprotonated 2-amino-5-nitroterephthalate anion and a dimethylammonium counter-ion on general positions and a water molecule that lies on a twofold rotation axis. Extensive hydrogen bonding is observed between the carboxylate group and the dimethylammonium ion, the water molecule and the carboxylic acid group, as well as between the amino group, the water molecule and the carboxylic acid group (N—H...O and O—H...O hydrogen bonds are involved). |
| first_indexed | 2024-12-11T16:34:17Z |
| format | Article |
| id | doaj.art-a8b8205b76e94eaa98268fa3e0e0ccec |
| institution | Directory Open Access Journal |
| issn | 2414-3146 |
| language | English |
| last_indexed | 2024-12-11T16:34:17Z |
| publishDate | 2016-01-01 |
| publisher | International Union of Crystallography |
| record_format | Article |
| series | IUCrData |
| spelling | doaj.art-a8b8205b76e94eaa98268fa3e0e0ccec2022-12-22T00:58:30ZengInternational Union of CrystallographyIUCrData2414-31462016-01-0111x16004810.1107/S2414314616000481sj4003Dimethylammonium 2-amino-5-nitroterephthalate hemihydrateMartin Krueger0Martin Albat1Florian Pieper2Norbert Stock3Max-Eyth-Strasse 2, 24118 Kiel, GermanyMax-Eyth-Strasse 2, 24118 Kiel, GermanyMax-Eyth-Strasse 2, 24118 Kiel, GermanyMax-Eyth-Strasse 2, 24118 Kiel, GermanyThe asymmetric unit of the title compound, C2H8N+·C8H5N2O6−·0.5H2O, comprises a monodeprotonated 2-amino-5-nitroterephthalate anion and a dimethylammonium counter-ion on general positions and a water molecule that lies on a twofold rotation axis. Extensive hydrogen bonding is observed between the carboxylate group and the dimethylammonium ion, the water molecule and the carboxylic acid group, as well as between the amino group, the water molecule and the carboxylic acid group (N—H...O and O—H...O hydrogen bonds are involved).http://scripts.iucr.org/cgi-bin/paper?S2414314616000481crystal structuredimethylammonium 2-amino-5-nitroterephtalatefunctionalized terephthalic acidH-bonding |
| spellingShingle | Martin Krueger Martin Albat Florian Pieper Norbert Stock Dimethylammonium 2-amino-5-nitroterephthalate hemihydrate IUCrData crystal structure dimethylammonium 2-amino-5-nitroterephtalate functionalized terephthalic acid H-bonding |
| title | Dimethylammonium 2-amino-5-nitroterephthalate hemihydrate |
| title_full | Dimethylammonium 2-amino-5-nitroterephthalate hemihydrate |
| title_fullStr | Dimethylammonium 2-amino-5-nitroterephthalate hemihydrate |
| title_full_unstemmed | Dimethylammonium 2-amino-5-nitroterephthalate hemihydrate |
| title_short | Dimethylammonium 2-amino-5-nitroterephthalate hemihydrate |
| title_sort | dimethylammonium 2 amino 5 nitroterephthalate hemihydrate |
| topic | crystal structure dimethylammonium 2-amino-5-nitroterephtalate functionalized terephthalic acid H-bonding |
| url | http://scripts.iucr.org/cgi-bin/paper?S2414314616000481 |
| work_keys_str_mv | AT martinkrueger dimethylammonium2amino5nitroterephthalatehemihydrate AT martinalbat dimethylammonium2amino5nitroterephthalatehemihydrate AT florianpieper dimethylammonium2amino5nitroterephthalatehemihydrate AT norbertstock dimethylammonium2amino5nitroterephthalatehemihydrate |