Crystal structure of 5-[bis(methylsulfonyl)methyl]-1,3-dimethyl-5-(methylsulfonyl)pyrimidine-2,4,6(1H,3H,5H)-trione
In the title compound, C10H16N2O9S3, the pyrimidine ring of the 1,3-dimethyl barbituric acid moiety has an envelope conformation with the C atom carrying the methylsulfonyl and bis(methylsulfonyl)methyl substituents as the flap. The dihedral angle between mean plane of the pyrimidine ring and the S/...
| Published in: | Acta Crystallographica Section E: Crystallographic Communications |
|---|---|
| Main Authors: | , , , , |
| Format: | Article |
| Language: | English |
| Published: |
International Union of Crystallography
2015-01-01
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| Subjects: | |
| Online Access: | http://scripts.iucr.org/cgi-bin/paper?S2056989014027455 |
| _version_ | 1856993364981841920 |
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| author | Eyad Mallah Ahmed Al-Sheikh Kamal Sweidan Wael Abu Dayyih Manfred Steimann |
| author_facet | Eyad Mallah Ahmed Al-Sheikh Kamal Sweidan Wael Abu Dayyih Manfred Steimann |
| author_sort | Eyad Mallah |
| collection | DOAJ |
| container_title | Acta Crystallographica Section E: Crystallographic Communications |
| description | In the title compound, C10H16N2O9S3, the pyrimidine ring of the 1,3-dimethyl barbituric acid moiety has an envelope conformation with the C atom carrying the methylsulfonyl and bis(methylsulfonyl)methyl substituents as the flap. The dihedral angle between mean plane of the pyrimidine ring and the S/C/S plane is 72.4 (3)°. In the crystal, molecules are linked via C—H...O hydrogen bonds, forming a three-dimensional structure. |
| format | Article |
| id | doaj-art-059c2264c378444abad1d4b67b7b8cd4 |
| institution | Directory of Open Access Journals |
| issn | 2056-9890 |
| language | English |
| publishDate | 2015-01-01 |
| publisher | International Union of Crystallography |
| record_format | Article |
| spelling | doaj-art-059c2264c378444abad1d4b67b7b8cd42025-08-19T19:52:44ZengInternational Union of CrystallographyActa Crystallographica Section E: Crystallographic Communications2056-98902015-01-01711o58o5910.1107/S2056989014027455su5040Crystal structure of 5-[bis(methylsulfonyl)methyl]-1,3-dimethyl-5-(methylsulfonyl)pyrimidine-2,4,6(1H,3H,5H)-trioneEyad Mallah0Ahmed Al-Sheikh1Kamal Sweidan2Wael Abu Dayyih3Manfred Steimann4Faculty of Pharmacy and Medical Science, University of Petra, Amman, JordanFaculty of Pharmacy and Medical Science, University of Petra, Amman, JordanDepartment of Chemistry, Faculty of Science, University of Jordan, Amman, JordanFaculty of Pharmacy and Medical Science, University of Petra, Amman, JordanInstitut für Anorganische Chemie der Universität Tübingen, Auf der Morgenstelle 18, 72076 Tübingen, GermanyIn the title compound, C10H16N2O9S3, the pyrimidine ring of the 1,3-dimethyl barbituric acid moiety has an envelope conformation with the C atom carrying the methylsulfonyl and bis(methylsulfonyl)methyl substituents as the flap. The dihedral angle between mean plane of the pyrimidine ring and the S/C/S plane is 72.4 (3)°. In the crystal, molecules are linked via C—H...O hydrogen bonds, forming a three-dimensional structure.http://scripts.iucr.org/cgi-bin/paper?S2056989014027455crystal structurebarbituric acidpyrimidinesmethylsulfonyltrionehydrogen bonding |
| spellingShingle | Eyad Mallah Ahmed Al-Sheikh Kamal Sweidan Wael Abu Dayyih Manfred Steimann Crystal structure of 5-[bis(methylsulfonyl)methyl]-1,3-dimethyl-5-(methylsulfonyl)pyrimidine-2,4,6(1H,3H,5H)-trione crystal structure barbituric acid pyrimidines methylsulfonyl trione hydrogen bonding |
| title | Crystal structure of 5-[bis(methylsulfonyl)methyl]-1,3-dimethyl-5-(methylsulfonyl)pyrimidine-2,4,6(1H,3H,5H)-trione |
| title_full | Crystal structure of 5-[bis(methylsulfonyl)methyl]-1,3-dimethyl-5-(methylsulfonyl)pyrimidine-2,4,6(1H,3H,5H)-trione |
| title_fullStr | Crystal structure of 5-[bis(methylsulfonyl)methyl]-1,3-dimethyl-5-(methylsulfonyl)pyrimidine-2,4,6(1H,3H,5H)-trione |
| title_full_unstemmed | Crystal structure of 5-[bis(methylsulfonyl)methyl]-1,3-dimethyl-5-(methylsulfonyl)pyrimidine-2,4,6(1H,3H,5H)-trione |
| title_short | Crystal structure of 5-[bis(methylsulfonyl)methyl]-1,3-dimethyl-5-(methylsulfonyl)pyrimidine-2,4,6(1H,3H,5H)-trione |
| title_sort | crystal structure of 5 bis methylsulfonyl methyl 1 3 dimethyl 5 methylsulfonyl pyrimidine 2 4 6 1h 3h 5h trione |
| topic | crystal structure barbituric acid pyrimidines methylsulfonyl trione hydrogen bonding |
| url | http://scripts.iucr.org/cgi-bin/paper?S2056989014027455 |
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