2-(4-Morpholine­carbothio­ylsulfan­yl)­acetic acid

The asymmetric unit of the title compound, C(7)H(11)NO(3)S(2), contains two independent mol­ecules with similar mol­ecular structures. The morpholine ring adopts a chair conformation, and the C(2)N—C(=S)—S fragment is planar in the two independent mol­ecules (r.m.s. deviations = 0.01 and 0.02 Å). Th...

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Detalles Bibliográficos
Autores principales: Lo, Kong Mun, Ng, Seik Weng
Formato: Texto
Lenguaje:English
Publicado: International Union of Crystallography 2010
Materias:
Organic Papers
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2979280/
https://www.ncbi.nlm.nih.gov/pubmed/21579132
http://dx.doi.org/10.1107/S1600536810012602
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author Lo, Kong Mun
Ng, Seik Weng
author_facet Lo, Kong Mun
Ng, Seik Weng
author_sort Lo, Kong Mun
collection PubMed
description The asymmetric unit of the title compound, C(7)H(11)NO(3)S(2), contains two independent mol­ecules with similar mol­ecular structures. The morpholine ring adopts a chair conformation, and the C(2)N—C(=S)—S fragment is planar in the two independent mol­ecules (r.m.s. deviations = 0.01 and 0.02 Å). The two mol­ecules are disposed about a false center of inversion and are held together by a pair of O—H⋯O hydrogen bonds. The crystal studied was a racemic twin; the minor twin component refined to 17%.
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spelling pubmed-29792802010-12-30 2-(4-Morpholine­carbothio­ylsulfan­yl)­acetic acid Lo, Kong Mun Ng, Seik Weng Acta Crystallogr Sect E Struct Rep Online Organic Papers The asymmetric unit of the title compound, C(7)H(11)NO(3)S(2), contains two independent mol­ecules with similar mol­ecular structures. The morpholine ring adopts a chair conformation, and the C(2)N—C(=S)—S fragment is planar in the two independent mol­ecules (r.m.s. deviations = 0.01 and 0.02 Å). The two mol­ecules are disposed about a false center of inversion and are held together by a pair of O—H⋯O hydrogen bonds. The crystal studied was a racemic twin; the minor twin component refined to 17%. International Union of Crystallography 2010-04-14 /pmc/articles/PMC2979280/ /pubmed/21579132 http://dx.doi.org/10.1107/S1600536810012602 Text en © Lo and Ng 2010 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
Lo, Kong Mun
Ng, Seik Weng
2-(4-Morpholine­carbothio­ylsulfan­yl)­acetic acid
title 2-(4-Morpholine­carbothio­ylsulfan­yl)­acetic acid
title_full 2-(4-Morpholine­carbothio­ylsulfan­yl)­acetic acid
title_fullStr 2-(4-Morpholine­carbothio­ylsulfan­yl)­acetic acid
title_full_unstemmed 2-(4-Morpholine­carbothio­ylsulfan­yl)­acetic acid
title_short 2-(4-Morpholine­carbothio­ylsulfan­yl)­acetic acid
title_sort 2-(4-morpholine­carbothio­ylsulfan­yl)­acetic acid
topic Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2979280/
https://www.ncbi.nlm.nih.gov/pubmed/21579132
http://dx.doi.org/10.1107/S1600536810012602
work_keys_str_mv AT lokongmun 24morpholinecarbothioylsulfanylaceticacid
AT ngseikweng 24morpholinecarbothioylsulfanylaceticacid

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