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Diammonium 1,1′,3,3′-tetramethyl-2,2′,4,4′,6,6′-hexaoxoperhydro-5,5′-bipyrimidine-5,5′-diide monohydrate
In the title hydrated salt, 2NH(4) (+)·C(12)H(12)N(4)O(6) (2−)·H(2)O, the two hexahydropyrimidine rings in the dianion are inclined to one another at a dihedral angle of 62.76 (5)°. In the crystal structure, the anions and water molecules are linked into sheets parallel to the bc plane by interm...
| Autores principales: | , , , , |
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| Formato: | Texto |
| Lenguaje: | English |
| Publicado: |
International Union of Crystallography
2009
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| Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2971361/ https://www.ncbi.nlm.nih.gov/pubmed/21578268 http://dx.doi.org/10.1107/S1600536809039968 |
| _version_ | 1782190609395613696 |
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| author | Fun, Hoong-Kun Goh, Jia Hao Reddy, B. Palakshi Vijayakumar, V. Sarveswari, S. |
| author_facet | Fun, Hoong-Kun Goh, Jia Hao Reddy, B. Palakshi Vijayakumar, V. Sarveswari, S. |
| author_sort | Fun, Hoong-Kun |
| collection | PubMed |
| description | In the title hydrated salt, 2NH(4) (+)·C(12)H(12)N(4)O(6) (2−)·H(2)O, the two hexahydropyrimidine rings in the dianion are inclined to one another at a dihedral angle of 62.76 (5)°. In the crystal structure, the anions and water molecules are linked into sheets parallel to the bc plane by intermolecular O—H⋯O hydrogen bonds and sustained by C—H⋯O contacts. The linking of the anions and water molecules with the cations by N—H⋯O hydrogen bonds creates a three-dimensional extended network. The crystal structure is further stabilized by very weak C—H⋯π interactions. |
| format | Text |
| id | pubmed-2971361 |
| institution | National Center for Biotechnology Information |
| language | English |
| publishDate | 2009 |
| publisher | International Union of Crystallography |
| record_format | MEDLINE/PubMed |
| spelling | pubmed-29713612010-12-30 Diammonium 1,1′,3,3′-tetramethyl-2,2′,4,4′,6,6′-hexaoxoperhydro-5,5′-bipyrimidine-5,5′-diide monohydrate Fun, Hoong-Kun Goh, Jia Hao Reddy, B. Palakshi Vijayakumar, V. Sarveswari, S. Acta Crystallogr Sect E Struct Rep Online Organic Papers In the title hydrated salt, 2NH(4) (+)·C(12)H(12)N(4)O(6) (2−)·H(2)O, the two hexahydropyrimidine rings in the dianion are inclined to one another at a dihedral angle of 62.76 (5)°. In the crystal structure, the anions and water molecules are linked into sheets parallel to the bc plane by intermolecular O—H⋯O hydrogen bonds and sustained by C—H⋯O contacts. The linking of the anions and water molecules with the cations by N—H⋯O hydrogen bonds creates a three-dimensional extended network. The crystal structure is further stabilized by very weak C—H⋯π interactions. International Union of Crystallography 2009-10-07 /pmc/articles/PMC2971361/ /pubmed/21578268 http://dx.doi.org/10.1107/S1600536809039968 Text en © Fun et al. 2009 http://creativecommons.org/licenses/by/2.0/uk/ This is an open-access article distributed under the terms of the Creative Commons Attribution Licence, which permits unrestricted use, distribution, and reproduction in any medium, provided the original authors and source are cited. |
| spellingShingle | Organic Papers Fun, Hoong-Kun Goh, Jia Hao Reddy, B. Palakshi Vijayakumar, V. Sarveswari, S. Diammonium 1,1′,3,3′-tetramethyl-2,2′,4,4′,6,6′-hexaoxoperhydro-5,5′-bipyrimidine-5,5′-diide monohydrate |
| title | Diammonium 1,1′,3,3′-tetramethyl-2,2′,4,4′,6,6′-hexaoxoperhydro-5,5′-bipyrimidine-5,5′-diide monohydrate |
| title_full | Diammonium 1,1′,3,3′-tetramethyl-2,2′,4,4′,6,6′-hexaoxoperhydro-5,5′-bipyrimidine-5,5′-diide monohydrate |
| title_fullStr | Diammonium 1,1′,3,3′-tetramethyl-2,2′,4,4′,6,6′-hexaoxoperhydro-5,5′-bipyrimidine-5,5′-diide monohydrate |
| title_full_unstemmed | Diammonium 1,1′,3,3′-tetramethyl-2,2′,4,4′,6,6′-hexaoxoperhydro-5,5′-bipyrimidine-5,5′-diide monohydrate |
| title_short | Diammonium 1,1′,3,3′-tetramethyl-2,2′,4,4′,6,6′-hexaoxoperhydro-5,5′-bipyrimidine-5,5′-diide monohydrate |
| title_sort | diammonium 1,1′,3,3′-tetramethyl-2,2′,4,4′,6,6′-hexaoxoperhydro-5,5′-bipyrimidine-5,5′-diide monohydrate |
| topic | Organic Papers |
| url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2971361/ https://www.ncbi.nlm.nih.gov/pubmed/21578268 http://dx.doi.org/10.1107/S1600536809039968 |
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