Crystal structure of S,N-dibenzyl-d-penicillamine monohydrate

In the asymmetric unit of the title compound, C(19)H(23)NO(2)S·H(2)O, there are two independent organic mol­ecules and two water mol­ecules. Both organic mol­ecules exist as the zwitterionic form. The dihedral angles between the planes of the rings in the organic mol­ecules are 86.84 (10) and 88.77 ...

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Detalles Bibliográficos
Autores principales: Yoshinari, Nobuto, Konno, Takumi
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2014
Materias:
Data Reports
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4257258/
https://www.ncbi.nlm.nih.gov/pubmed/25484833
http://dx.doi.org/10.1107/S1600536814023459
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author Yoshinari, Nobuto
Konno, Takumi
author_facet Yoshinari, Nobuto
Konno, Takumi
author_sort Yoshinari, Nobuto
collection PubMed
description In the asymmetric unit of the title compound, C(19)H(23)NO(2)S·H(2)O, there are two independent organic mol­ecules and two water mol­ecules. Both organic mol­ecules exist as the zwitterionic form. The dihedral angles between the planes of the rings in the organic mol­ecules are 86.84 (10) and 88.77 (11)°. An intramolecular N—H⋯S hydrogen bond occurs. In the crystal, organic and water mol­ecules are linked by N—H⋯O and O—H⋯O hydrogen bonds, generating a tape structure running along the b-axis direction.
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spelling pubmed-42572582014-12-05 Crystal structure of S,N-dibenzyl-d-penicillamine monohydrate Yoshinari, Nobuto Konno, Takumi Acta Crystallogr Sect E Struct Rep Online Data Reports In the asymmetric unit of the title compound, C(19)H(23)NO(2)S·H(2)O, there are two independent organic mol­ecules and two water mol­ecules. Both organic mol­ecules exist as the zwitterionic form. The dihedral angles between the planes of the rings in the organic mol­ecules are 86.84 (10) and 88.77 (11)°. An intramolecular N—H⋯S hydrogen bond occurs. In the crystal, organic and water mol­ecules are linked by N—H⋯O and O—H⋯O hydrogen bonds, generating a tape structure running along the b-axis direction. International Union of Crystallography 2014-10-29 /pmc/articles/PMC4257258/ /pubmed/25484833 http://dx.doi.org/10.1107/S1600536814023459 Text en © Yoshinari and Konno 2014 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 Data Reports
Yoshinari, Nobuto
Konno, Takumi
Crystal structure of S,N-dibenzyl-d-penicillamine monohydrate
title Crystal structure of S,N-dibenzyl-d-penicillamine monohydrate
title_full Crystal structure of S,N-dibenzyl-d-penicillamine monohydrate
title_fullStr Crystal structure of S,N-dibenzyl-d-penicillamine monohydrate
title_full_unstemmed Crystal structure of S,N-dibenzyl-d-penicillamine monohydrate
title_short Crystal structure of S,N-dibenzyl-d-penicillamine monohydrate
title_sort crystal structure of s,n-dibenzyl-d-penicillamine monohydrate
topic Data Reports
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4257258/
https://www.ncbi.nlm.nih.gov/pubmed/25484833
http://dx.doi.org/10.1107/S1600536814023459
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