2,6-Diamino-4-oxo-3,4-dihydropyrimidin-1-ium chloride dihydrate
In the crystal structure of the title compound, C(4)H(7)N(4)O(+)center dot-Cl-center dot 2H(2)O, adjacent cations are connected to one another through N-H center dot center dot center dot O hydrogen bonds, forming infinite chains along the b axis. These chains are further hydrogen bonded to the chlo...
| Main Authors: | , , |
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| Format: | Article |
| Language: | English |
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International Union of Crystallography
2010
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| Subjects: | |
| Online Access: | http://eprints.um.edu.my/5314/1/Gwaram-2010-2%2C6-Diamino-4-oxo-3.pdf |
| _version_ | 1825719073943584768 |
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| author | Gwaram, N.S. Ali, Hapipah Mohd Khaledi, H. |
| author_facet | Gwaram, N.S. Ali, Hapipah Mohd Khaledi, H. |
| author_sort | Gwaram, N.S. |
| collection | UM |
| description | In the crystal structure of the title compound, C(4)H(7)N(4)O(+)center dot-Cl-center dot 2H(2)O, adjacent cations are connected to one another through N-H center dot center dot center dot O hydrogen bonds, forming infinite chains along the b axis. These chains are further hydrogen bonded to the chloride anions and water molecules, resulting in a three-dimensional network. The pyrimidine rings of adjacent molecules are arranged in an antiparallel manner above each other with centroid-centroid distances of 3.435 (1) angstrom, indicative of pi-pi interactions. |
| first_indexed | 2024-03-06T05:14:05Z |
| format | Article |
| id | um.eprints-5314 |
| institution | Universiti Malaya |
| language | English |
| last_indexed | 2024-03-06T05:14:05Z |
| publishDate | 2010 |
| publisher | International Union of Crystallography |
| record_format | dspace |
| spelling | um.eprints-53142019-01-29T09:14:51Z http://eprints.um.edu.my/5314/ 2,6-Diamino-4-oxo-3,4-dihydropyrimidin-1-ium chloride dihydrate Gwaram, N.S. Ali, Hapipah Mohd Khaledi, H. QD Chemistry In the crystal structure of the title compound, C(4)H(7)N(4)O(+)center dot-Cl-center dot 2H(2)O, adjacent cations are connected to one another through N-H center dot center dot center dot O hydrogen bonds, forming infinite chains along the b axis. These chains are further hydrogen bonded to the chloride anions and water molecules, resulting in a three-dimensional network. The pyrimidine rings of adjacent molecules are arranged in an antiparallel manner above each other with centroid-centroid distances of 3.435 (1) angstrom, indicative of pi-pi interactions. International Union of Crystallography 2010 Article PeerReviewed application/pdf en http://eprints.um.edu.my/5314/1/Gwaram-2010-2%2C6-Diamino-4-oxo-3.pdf Gwaram, N.S. and Ali, Hapipah Mohd and Khaledi, H. (2010) 2,6-Diamino-4-oxo-3,4-dihydropyrimidin-1-ium chloride dihydrate. Acta Crystallographica Section E: Structure Reports Online, 66. O2294-U216. ISSN 1600-5368, DOI https://doi.org/10.1107/s1600536810031557 <https://doi.org/10.1107/s1600536810031557>. http://scripts.iucr.org/cgi-bin/paper?S1600536810031557 10.1107/s1600536810031557 |
| spellingShingle | QD Chemistry Gwaram, N.S. Ali, Hapipah Mohd Khaledi, H. 2,6-Diamino-4-oxo-3,4-dihydropyrimidin-1-ium chloride dihydrate |
| title | 2,6-Diamino-4-oxo-3,4-dihydropyrimidin-1-ium chloride dihydrate |
| title_full | 2,6-Diamino-4-oxo-3,4-dihydropyrimidin-1-ium chloride dihydrate |
| title_fullStr | 2,6-Diamino-4-oxo-3,4-dihydropyrimidin-1-ium chloride dihydrate |
| title_full_unstemmed | 2,6-Diamino-4-oxo-3,4-dihydropyrimidin-1-ium chloride dihydrate |
| title_short | 2,6-Diamino-4-oxo-3,4-dihydropyrimidin-1-ium chloride dihydrate |
| title_sort | 2 6 diamino 4 oxo 3 4 dihydropyrimidin 1 ium chloride dihydrate |
| topic | QD Chemistry |
| url | http://eprints.um.edu.my/5314/1/Gwaram-2010-2%2C6-Diamino-4-oxo-3.pdf |
| work_keys_str_mv | AT gwaramns 26diamino4oxo34dihydropyrimidin1iumchloridedihydrate AT alihapipahmohd 26diamino4oxo34dihydropyrimidin1iumchloridedihydrate AT khaledih 26diamino4oxo34dihydropyrimidin1iumchloridedihydrate |