Ethyl (2RS,3SR,4RS)-1-ethyl-2-(furan-2-yl)-4-hydroxy-5-oxopyrrolidine-3-carboxylate
The title racemic oxopyrrolidine compound, C13H17NO5, contains three stereogenic centres and crystallizes with two molecules in the asymmetric unit. The five-membered pyrrolidine rings in both molecules exhibit envelope conformations. The N-ethyl group of one of the molecules is disordered over two...
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International Union of Crystallography
2024-11-01
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| Online Access: | https://journals.iucr.org/paper?S2414314624010885 |
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| author | Nor Habibah Mohd Rosli Mohd Fazli Mohammat Mohd Abdul Fatah Abdul Manan David B. Cordes Aidan P. McKay |
| author_facet | Nor Habibah Mohd Rosli Mohd Fazli Mohammat Mohd Abdul Fatah Abdul Manan David B. Cordes Aidan P. McKay |
| author_sort | Nor Habibah Mohd Rosli |
| collection | DOAJ |
| description | The title racemic oxopyrrolidine compound, C13H17NO5, contains three stereogenic centres and crystallizes with two molecules in the asymmetric unit. The five-membered pyrrolidine rings in both molecules exhibit envelope conformations. The N-ethyl group of one of the molecules is disordered over two sets of sites in a 0.836 (4):0.164 (4) ratio. In the crystal, both molecules form inversion dimers through pairwise O—H...O hydrogen bonds, generating R22(10) loops, which are linked into a three-dimensional network by weak C—H...O hydrogen bonds. |
| format | Article |
| id | doaj-art-0e8491de1d784a0fb3734555bcd6ee77 |
| institution | OA Journals |
| issn | 2414-3146 |
| language | English |
| publishDate | 2024-11-01 |
| publisher | International Union of Crystallography |
| record_format | Article |
| series | IUCrData |
| spelling | doaj-art-0e8491de1d784a0fb3734555bcd6ee772025-08-20T02:19:08ZengInternational Union of CrystallographyIUCrData2414-31462024-11-01911x24108810.1107/S2414314624010885hb4491Ethyl (2RS,3SR,4RS)-1-ethyl-2-(furan-2-yl)-4-hydroxy-5-oxopyrrolidine-3-carboxylateNor Habibah Mohd Rosli0Mohd Fazli Mohammat1Mohd Abdul Fatah Abdul Manan2David B. Cordes3Aidan P. McKay4Faculty of Applied Sciences, Universiti Teknologi MARA (UiTM) Pahang, Jengka Campus 26400, Bandar Tun Abdul Razak Jengka, Pahang, MalaysiaCentre of Chemical Synthesis & Polymer Technology, Institute of Science, Universiti Teknologi MARA Puncak Alam, 42300 Puncak Alam, Selangor, MalaysiaFaculty of Applied Sciences, Universiti Teknologi MARA, 40450 Shah Alam, Selangor, MalaysiaEaStCHEM School of Chemistry, University of St Andrews, St Andrews, Fife KY16 9ST, United KingdomEaStCHEM School of Chemistry, University of St Andrews, St Andrews, Fife KY16 9ST, United KingdomThe title racemic oxopyrrolidine compound, C13H17NO5, contains three stereogenic centres and crystallizes with two molecules in the asymmetric unit. The five-membered pyrrolidine rings in both molecules exhibit envelope conformations. The N-ethyl group of one of the molecules is disordered over two sets of sites in a 0.836 (4):0.164 (4) ratio. In the crystal, both molecules form inversion dimers through pairwise O—H...O hydrogen bonds, generating R22(10) loops, which are linked into a three-dimensional network by weak C—H...O hydrogen bonds.https://journals.iucr.org/paper?S2414314624010885crystal structureoxopyrrolidineracemicenvelope conformationhydrogen bonds |
| spellingShingle | Nor Habibah Mohd Rosli Mohd Fazli Mohammat Mohd Abdul Fatah Abdul Manan David B. Cordes Aidan P. McKay Ethyl (2RS,3SR,4RS)-1-ethyl-2-(furan-2-yl)-4-hydroxy-5-oxopyrrolidine-3-carboxylate IUCrData crystal structure oxopyrrolidine racemic envelope conformation hydrogen bonds |
| title | Ethyl (2RS,3SR,4RS)-1-ethyl-2-(furan-2-yl)-4-hydroxy-5-oxopyrrolidine-3-carboxylate |
| title_full | Ethyl (2RS,3SR,4RS)-1-ethyl-2-(furan-2-yl)-4-hydroxy-5-oxopyrrolidine-3-carboxylate |
| title_fullStr | Ethyl (2RS,3SR,4RS)-1-ethyl-2-(furan-2-yl)-4-hydroxy-5-oxopyrrolidine-3-carboxylate |
| title_full_unstemmed | Ethyl (2RS,3SR,4RS)-1-ethyl-2-(furan-2-yl)-4-hydroxy-5-oxopyrrolidine-3-carboxylate |
| title_short | Ethyl (2RS,3SR,4RS)-1-ethyl-2-(furan-2-yl)-4-hydroxy-5-oxopyrrolidine-3-carboxylate |
| title_sort | ethyl 2rs 3sr 4rs 1 ethyl 2 furan 2 yl 4 hydroxy 5 oxopyrrolidine 3 carboxylate |
| topic | crystal structure oxopyrrolidine racemic envelope conformation hydrogen bonds |
| url | https://journals.iucr.org/paper?S2414314624010885 |
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