Ethyl (2RS,3SR,4RS)-1-ethyl-2-(furan-2-yl)-4-hydroxy-5-oxopyrrolidine-3-carboxylate

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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Published in:IUCrData
Main Author: Mohd Rosli N.H.; Mohammat M.F.; Abdul Manan M.A.F.; Cordes D.B.; McKay A.P.
Format: Data paper
Language:English
Published: International Union of Crystallography 2024
Online Access:https://www.scopus.com/inward/record.uri?eid=2-s2.0-85211589315&doi=10.1107%2fS2414314624010885&partnerID=40&md5=c9efd026c1a9944b0764b8c759af9ca9
id 2-s2.0-85211589315
spelling 2-s2.0-85211589315
Mohd Rosli N.H.; Mohammat M.F.; Abdul Manan M.A.F.; Cordes D.B.; McKay A.P.
Ethyl (2RS,3SR,4RS)-1-ethyl-2-(furan-2-yl)-4-hydroxy-5-oxopyrrolidine-3-carboxylate
2024
IUCrData
9
Pt 11
10.1107/S2414314624010885
https://www.scopus.com/inward/record.uri?eid=2-s2.0-85211589315&doi=10.1107%2fS2414314624010885&partnerID=40&md5=c9efd026c1a9944b0764b8c759af9ca9
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. © 2024 International Union of Crystallography. All rights reserved.
International Union of Crystallography
24143146
English
Data paper
All Open Access; Gold Open Access
author Mohd Rosli N.H.; Mohammat M.F.; Abdul Manan M.A.F.; Cordes D.B.; McKay A.P.
spellingShingle Mohd Rosli N.H.; Mohammat M.F.; Abdul Manan M.A.F.; Cordes D.B.; McKay A.P.
Ethyl (2RS,3SR,4RS)-1-ethyl-2-(furan-2-yl)-4-hydroxy-5-oxopyrrolidine-3-carboxylate
author_facet Mohd Rosli N.H.; Mohammat M.F.; Abdul Manan M.A.F.; Cordes D.B.; McKay A.P.
author_sort Mohd Rosli N.H.; Mohammat M.F.; Abdul Manan M.A.F.; Cordes D.B.; McKay A.P.
title 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_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_sort Ethyl (2RS,3SR,4RS)-1-ethyl-2-(furan-2-yl)-4-hydroxy-5-oxopyrrolidine-3-carboxylate
publishDate 2024
container_title IUCrData
container_volume 9
container_issue Pt 11
doi_str_mv 10.1107/S2414314624010885
url https://www.scopus.com/inward/record.uri?eid=2-s2.0-85211589315&doi=10.1107%2fS2414314624010885&partnerID=40&md5=c9efd026c1a9944b0764b8c759af9ca9
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. © 2024 International Union of Crystallography. All rights reserved.
publisher International Union of Crystallography
issn 24143146
language English
format Data paper
accesstype All Open Access; Gold Open Access
record_format scopus
collection Scopus
_version_ 1820775431244087296

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