2,3,4,6,7,8,9,10-Octa­hydro­pyrimido[1,2-a]azepin-1-ium 2-cyano-1-(2,6-dimethylanilino)-2-(phenyl­sulfonyl)ethenethiol­ate

In the title compound, C(9)H(17)N(2) (+)·C(17)H(15)N(2)O(2)S(2) (−), the Csp (2)—N bonds in the tetra­hydro­pyrimidine ring of the cation are delocalized. The negative charge is localized on the S atom of the thione group. Cations and anions are linked by N—H⋯S inter­molecular hydrogen bonds....

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Detalles Bibliográficos
Autores principales: Shishkina, Svetlana V., Shishkin, Oleg V., Vlasenko, Yuriy D., Parkhomenko, Oleksiy O., Kovalenko, Sergey M.
Formato: Texto
Lenguaje:English
Publicado: International Union of Crystallography 2007
Materias:
Organic Papers
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2915312/
https://www.ncbi.nlm.nih.gov/pubmed/21200820
http://dx.doi.org/10.1107/S1600536807065518
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author Shishkina, Svetlana V.
Shishkin, Oleg V.
Vlasenko, Yuriy D.
Parkhomenko, Oleksiy O.
Kovalenko, Sergey M.
author_facet Shishkina, Svetlana V.
Shishkin, Oleg V.
Vlasenko, Yuriy D.
Parkhomenko, Oleksiy O.
Kovalenko, Sergey M.
author_sort Shishkina, Svetlana V.
collection PubMed
description In the title compound, C(9)H(17)N(2) (+)·C(17)H(15)N(2)O(2)S(2) (−), the Csp (2)—N bonds in the tetra­hydro­pyrimidine ring of the cation are delocalized. The negative charge is localized on the S atom of the thione group. Cations and anions are linked by N—H⋯S inter­molecular hydrogen bonds.
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spelling pubmed-29153122010-12-30 2,3,4,6,7,8,9,10-Octa­hydro­pyrimido[1,2-a]azepin-1-ium 2-cyano-1-(2,6-dimethylanilino)-2-(phenyl­sulfonyl)ethenethiol­ate Shishkina, Svetlana V. Shishkin, Oleg V. Vlasenko, Yuriy D. Parkhomenko, Oleksiy O. Kovalenko, Sergey M. Acta Crystallogr Sect E Struct Rep Online Organic Papers In the title compound, C(9)H(17)N(2) (+)·C(17)H(15)N(2)O(2)S(2) (−), the Csp (2)—N bonds in the tetra­hydro­pyrimidine ring of the cation are delocalized. The negative charge is localized on the S atom of the thione group. Cations and anions are linked by N—H⋯S inter­molecular hydrogen bonds. International Union of Crystallography 2007-12-12 /pmc/articles/PMC2915312/ /pubmed/21200820 http://dx.doi.org/10.1107/S1600536807065518 Text en © International Union of Crystallography 2008 http://journals.iucr.org/services/termsofuse.html This is an open-access article distributed under the terms described at http://journals.iucr.org/services/termsofuse.html.
spellingShingle Organic Papers
Shishkina, Svetlana V.
Shishkin, Oleg V.
Vlasenko, Yuriy D.
Parkhomenko, Oleksiy O.
Kovalenko, Sergey M.
2,3,4,6,7,8,9,10-Octa­hydro­pyrimido[1,2-a]azepin-1-ium 2-cyano-1-(2,6-dimethylanilino)-2-(phenyl­sulfonyl)ethenethiol­ate
title 2,3,4,6,7,8,9,10-Octa­hydro­pyrimido[1,2-a]azepin-1-ium 2-cyano-1-(2,6-dimethylanilino)-2-(phenyl­sulfonyl)ethenethiol­ate
title_full 2,3,4,6,7,8,9,10-Octa­hydro­pyrimido[1,2-a]azepin-1-ium 2-cyano-1-(2,6-dimethylanilino)-2-(phenyl­sulfonyl)ethenethiol­ate
title_fullStr 2,3,4,6,7,8,9,10-Octa­hydro­pyrimido[1,2-a]azepin-1-ium 2-cyano-1-(2,6-dimethylanilino)-2-(phenyl­sulfonyl)ethenethiol­ate
title_full_unstemmed 2,3,4,6,7,8,9,10-Octa­hydro­pyrimido[1,2-a]azepin-1-ium 2-cyano-1-(2,6-dimethylanilino)-2-(phenyl­sulfonyl)ethenethiol­ate
title_short 2,3,4,6,7,8,9,10-Octa­hydro­pyrimido[1,2-a]azepin-1-ium 2-cyano-1-(2,6-dimethylanilino)-2-(phenyl­sulfonyl)ethenethiol­ate
title_sort 2,3,4,6,7,8,9,10-octa­hydro­pyrimido[1,2-a]azepin-1-ium 2-cyano-1-(2,6-dimethylanilino)-2-(phenyl­sulfonyl)ethenethiol­ate
topic Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2915312/
https://www.ncbi.nlm.nih.gov/pubmed/21200820
http://dx.doi.org/10.1107/S1600536807065518
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