4-(Pyrimidin-2-yl)-1-thia-4-azaspiro[4.5]decan-3-one
The title compound, C12H15N3OS, features an envelope conformation for the 1,3-thiazolidin-4-one ring with the S atom as the flap atom. The pyrimidine ring is almost orthogonal to the 1,3-thiazolidin-4-one ring as indicated by the N—C—C—N torsion angle of &am...
| Main Authors: | , , , , , |
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| Format: | Article |
| Language: | English |
| Published: |
International Union of Crystallography
2009-12-01
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| Series: | Acta Crystallographica Section E |
| Online Access: | http://scripts.iucr.org/cgi-bin/paper?S1600536809049460 |
| _version_ | 1818488764628992000 |
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| author | James L. Wardell Edward R. T. Tiekink Wilson Cunico Bruna B. Drawanz Patrícia D. Neuenfeldt Solange M. S. V. Wardell |
| author_facet | James L. Wardell Edward R. T. Tiekink Wilson Cunico Bruna B. Drawanz Patrícia D. Neuenfeldt Solange M. S. V. Wardell |
| author_sort | James L. Wardell |
| collection | DOAJ |
| description | The title compound, C12H15N3OS, features an envelope conformation for the 1,3-thiazolidin-4-one ring with the S atom as the flap atom. The pyrimidine ring is almost orthogonal to the 1,3-thiazolidin-4-one ring as indicated by the N—C—C—N torsion angle of −111.96 (18)°. Supramolecular dimers are formed in the crystal structure through the agency of C—H...O contacts occurring between centrosymmetrically related molecules. These are linked into supramolecular tapes along [100] via C—H...S contacts. |
| first_indexed | 2024-12-10T16:55:21Z |
| format | Article |
| id | doaj.art-5a897d458b474dfe9c27930c0aff58ca |
| institution | Directory Open Access Journal |
| issn | 1600-5368 |
| language | English |
| last_indexed | 2024-12-10T16:55:21Z |
| publishDate | 2009-12-01 |
| publisher | International Union of Crystallography |
| record_format | Article |
| series | Acta Crystallographica Section E |
| spelling | doaj.art-5a897d458b474dfe9c27930c0aff58ca2022-12-22T01:40:46ZengInternational Union of CrystallographyActa Crystallographica Section E1600-53682009-12-016512o3190o319110.1107/S16005368090494604-(Pyrimidin-2-yl)-1-thia-4-azaspiro[4.5]decan-3-oneJames L. WardellEdward R. T. TiekinkWilson CunicoBruna B. DrawanzPatrícia D. NeuenfeldtSolange M. S. V. WardellThe title compound, C12H15N3OS, features an envelope conformation for the 1,3-thiazolidin-4-one ring with the S atom as the flap atom. The pyrimidine ring is almost orthogonal to the 1,3-thiazolidin-4-one ring as indicated by the N—C—C—N torsion angle of −111.96 (18)°. Supramolecular dimers are formed in the crystal structure through the agency of C—H...O contacts occurring between centrosymmetrically related molecules. These are linked into supramolecular tapes along [100] via C—H...S contacts.http://scripts.iucr.org/cgi-bin/paper?S1600536809049460 |
| spellingShingle | James L. Wardell Edward R. T. Tiekink Wilson Cunico Bruna B. Drawanz Patrícia D. Neuenfeldt Solange M. S. V. Wardell 4-(Pyrimidin-2-yl)-1-thia-4-azaspiro[4.5]decan-3-one Acta Crystallographica Section E |
| title | 4-(Pyrimidin-2-yl)-1-thia-4-azaspiro[4.5]decan-3-one |
| title_full | 4-(Pyrimidin-2-yl)-1-thia-4-azaspiro[4.5]decan-3-one |
| title_fullStr | 4-(Pyrimidin-2-yl)-1-thia-4-azaspiro[4.5]decan-3-one |
| title_full_unstemmed | 4-(Pyrimidin-2-yl)-1-thia-4-azaspiro[4.5]decan-3-one |
| title_short | 4-(Pyrimidin-2-yl)-1-thia-4-azaspiro[4.5]decan-3-one |
| title_sort | 4 pyrimidin 2 yl 1 thia 4 azaspiro 4 5 decan 3 one |
| url | http://scripts.iucr.org/cgi-bin/paper?S1600536809049460 |
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