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Bis(2-amino-5-benzyl-3-eth­oxy­carbonyl-4,5,6,7-tetra­hydro­thieno[3,2-c]pyridin-5-ium) bis­(4-meth­oxy­phen­yl)di­phos­phon­ate

The asymmetric unit of the title salt, 2C(17)H(21)N(2)O(2)S(+)·C(14)H(14)O(7)P(2) (2−), contains half of a centrosymmetric bis­(4-meth­oxy­phen­yl)di­phospho­nate anion and one 2-amino-5-benzyl-3-eth­oxy­carbonyl-4,5,6,7-tetra­hydro­thieno[3,2-c]pyri­din-5-ium cation. In the anion, the O atoms of th...

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Autores principales: Akkurt, Mehmet, Mague, Joel T., Mohamed, Shaaban K., Younes, Sabry H. H., Albayati, Mustafa R.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2014
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3998403/
https://www.ncbi.nlm.nih.gov/pubmed/24765038
http://dx.doi.org/10.1107/S1600536814003766
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author Akkurt, Mehmet
Mague, Joel T.
Mohamed, Shaaban K.
Younes, Sabry H. H.
Albayati, Mustafa R.
author_facet Akkurt, Mehmet
Mague, Joel T.
Mohamed, Shaaban K.
Younes, Sabry H. H.
Albayati, Mustafa R.
author_sort Akkurt, Mehmet
collection PubMed
description The asymmetric unit of the title salt, 2C(17)H(21)N(2)O(2)S(+)·C(14)H(14)O(7)P(2) (2−), contains half of a centrosymmetric bis­(4-meth­oxy­phen­yl)di­phospho­nate anion and one 2-amino-5-benzyl-3-eth­oxy­carbonyl-4,5,6,7-tetra­hydro­thieno[3,2-c]pyri­din-5-ium cation. In the anion, the O atoms of the di­phospho­nate group are disordered over two positions with equal occupancies. In the cation, the ethyl group is disordered over two orientations with a refined occupancy ratio of 0.753 (5):0.247 (5), and the tetra­hydro­pyridinium ring adopts a distorted half-chair conformation. In the crystal, the ions are linked by C—H⋯O, N—H⋯O and C—H⋯S hydrogen bonds into a three-dimensional network.
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spelling pubmed-39984032014-04-24 Bis(2-amino-5-benzyl-3-eth­oxy­carbonyl-4,5,6,7-tetra­hydro­thieno[3,2-c]pyridin-5-ium) bis­(4-meth­oxy­phen­yl)di­phos­phon­ate Akkurt, Mehmet Mague, Joel T. Mohamed, Shaaban K. Younes, Sabry H. H. Albayati, Mustafa R. Acta Crystallogr Sect E Struct Rep Online Organic Papers The asymmetric unit of the title salt, 2C(17)H(21)N(2)O(2)S(+)·C(14)H(14)O(7)P(2) (2−), contains half of a centrosymmetric bis­(4-meth­oxy­phen­yl)di­phospho­nate anion and one 2-amino-5-benzyl-3-eth­oxy­carbonyl-4,5,6,7-tetra­hydro­thieno[3,2-c]pyri­din-5-ium cation. In the anion, the O atoms of the di­phospho­nate group are disordered over two positions with equal occupancies. In the cation, the ethyl group is disordered over two orientations with a refined occupancy ratio of 0.753 (5):0.247 (5), and the tetra­hydro­pyridinium ring adopts a distorted half-chair conformation. In the crystal, the ions are linked by C—H⋯O, N—H⋯O and C—H⋯S hydrogen bonds into a three-dimensional network. International Union of Crystallography 2014-02-22 /pmc/articles/PMC3998403/ /pubmed/24765038 http://dx.doi.org/10.1107/S1600536814003766 Text en © Akkurt et al. 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 Organic Papers
Akkurt, Mehmet
Mague, Joel T.
Mohamed, Shaaban K.
Younes, Sabry H. H.
Albayati, Mustafa R.
Bis(2-amino-5-benzyl-3-eth­oxy­carbonyl-4,5,6,7-tetra­hydro­thieno[3,2-c]pyridin-5-ium) bis­(4-meth­oxy­phen­yl)di­phos­phon­ate
title Bis(2-amino-5-benzyl-3-eth­oxy­carbonyl-4,5,6,7-tetra­hydro­thieno[3,2-c]pyridin-5-ium) bis­(4-meth­oxy­phen­yl)di­phos­phon­ate
title_full Bis(2-amino-5-benzyl-3-eth­oxy­carbonyl-4,5,6,7-tetra­hydro­thieno[3,2-c]pyridin-5-ium) bis­(4-meth­oxy­phen­yl)di­phos­phon­ate
title_fullStr Bis(2-amino-5-benzyl-3-eth­oxy­carbonyl-4,5,6,7-tetra­hydro­thieno[3,2-c]pyridin-5-ium) bis­(4-meth­oxy­phen­yl)di­phos­phon­ate
title_full_unstemmed Bis(2-amino-5-benzyl-3-eth­oxy­carbonyl-4,5,6,7-tetra­hydro­thieno[3,2-c]pyridin-5-ium) bis­(4-meth­oxy­phen­yl)di­phos­phon­ate
title_short Bis(2-amino-5-benzyl-3-eth­oxy­carbonyl-4,5,6,7-tetra­hydro­thieno[3,2-c]pyridin-5-ium) bis­(4-meth­oxy­phen­yl)di­phos­phon­ate
title_sort bis(2-amino-5-benzyl-3-eth­oxy­carbonyl-4,5,6,7-tetra­hydro­thieno[3,2-c]pyridin-5-ium) bis­(4-meth­oxy­phen­yl)di­phos­phon­ate
topic Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3998403/
https://www.ncbi.nlm.nih.gov/pubmed/24765038
http://dx.doi.org/10.1107/S1600536814003766
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