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Ammonium 4,4-difluoro-1,3,2-dithia­zetin-2-ide 1,1,3,3-tetra­oxide

The asymmetric unit of the title compound, NH(4) (+)·CF(2)NO(4)S(2) (−), consists of two crystallographically independent ammonium cations and two 4,4-difluoro-1,3,2-dithia­zetin-2-ide 1,1,3,3-tetra­oxide anions all located in general positions. The S—C—S—N rings of both crystallographically indepen...

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Detalles Bibliográficos
Autores principales: Finze, Maik, Reiss, Guido J.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2012
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3393267/
https://www.ncbi.nlm.nih.gov/pubmed/22807824
http://dx.doi.org/10.1107/S1600536812024221
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author Finze, Maik
Reiss, Guido J.
author_facet Finze, Maik
Reiss, Guido J.
author_sort Finze, Maik
collection PubMed
description The asymmetric unit of the title compound, NH(4) (+)·CF(2)NO(4)S(2) (−), consists of two crystallographically independent ammonium cations and two 4,4-difluoro-1,3,2-dithia­zetin-2-ide 1,1,3,3-tetra­oxide anions all located in general positions. The S—C—S—N rings of both crystallographically independent anions are almost planar, with the N atom bent out of the plane by 9.82 (5) and 12.82 (4)°. The structure was determined from a crystal twinned by inversion, with refined components in the ratio 0.73 (4):0.27 (4). Anions and cations are connected via hydrogen bonds (N—H⋯O and N—H⋯N) to form a three-dimensional framework. This framework is composed of two different layers parallel to the ab plane, which are built by the ammonium cations on the one hand and the complex cyclic anions on the other.
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spelling pubmed-33932672012-07-17 Ammonium 4,4-difluoro-1,3,2-dithia­zetin-2-ide 1,1,3,3-tetra­oxide Finze, Maik Reiss, Guido J. Acta Crystallogr Sect E Struct Rep Online Organic Papers The asymmetric unit of the title compound, NH(4) (+)·CF(2)NO(4)S(2) (−), consists of two crystallographically independent ammonium cations and two 4,4-difluoro-1,3,2-dithia­zetin-2-ide 1,1,3,3-tetra­oxide anions all located in general positions. The S—C—S—N rings of both crystallographically independent anions are almost planar, with the N atom bent out of the plane by 9.82 (5) and 12.82 (4)°. The structure was determined from a crystal twinned by inversion, with refined components in the ratio 0.73 (4):0.27 (4). Anions and cations are connected via hydrogen bonds (N—H⋯O and N—H⋯N) to form a three-dimensional framework. This framework is composed of two different layers parallel to the ab plane, which are built by the ammonium cations on the one hand and the complex cyclic anions on the other. International Union of Crystallography 2012-06-02 /pmc/articles/PMC3393267/ /pubmed/22807824 http://dx.doi.org/10.1107/S1600536812024221 Text en © Finze and Reiss 2012 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
Finze, Maik
Reiss, Guido J.
Ammonium 4,4-difluoro-1,3,2-dithia­zetin-2-ide 1,1,3,3-tetra­oxide
title Ammonium 4,4-difluoro-1,3,2-dithia­zetin-2-ide 1,1,3,3-tetra­oxide
title_full Ammonium 4,4-difluoro-1,3,2-dithia­zetin-2-ide 1,1,3,3-tetra­oxide
title_fullStr Ammonium 4,4-difluoro-1,3,2-dithia­zetin-2-ide 1,1,3,3-tetra­oxide
title_full_unstemmed Ammonium 4,4-difluoro-1,3,2-dithia­zetin-2-ide 1,1,3,3-tetra­oxide
title_short Ammonium 4,4-difluoro-1,3,2-dithia­zetin-2-ide 1,1,3,3-tetra­oxide
title_sort ammonium 4,4-difluoro-1,3,2-dithia­zetin-2-ide 1,1,3,3-tetra­oxide
topic Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3393267/
https://www.ncbi.nlm.nih.gov/pubmed/22807824
http://dx.doi.org/10.1107/S1600536812024221
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AT reissguidoj ammonium44difluoro132dithiazetin2ide1133tetraoxide