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Bis{(R)-1-(3-amino­sulfonyl-4-meth­oxy­phen­yl)-N-[2-(2-eth­oxy­phen­oxy)eth­yl]propan-2-aminium} adipate tetra­hydrate

The title compound, 2C(20)H(29)N(2)O(5)S(+)·C(6)H(8)O(4) (2−)·4H(2)O, which was found to be optically active, is a relatively rare example of a chiral compound crystallizing in the triclinic crystal system. The dihedral angles between the phenyl rings of the cations are 60.03 (15) and 62.03 (16)°, w...

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Detalles Bibliográficos
Autores principales: Ham, Zoran, Meden, Anton, Kasunič, Marta
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2013
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3629575/
https://www.ncbi.nlm.nih.gov/pubmed/23634062
http://dx.doi.org/10.1107/S1600536813005254
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author Ham, Zoran
Meden, Anton
Kasunič, Marta
author_facet Ham, Zoran
Meden, Anton
Kasunič, Marta
author_sort Ham, Zoran
collection PubMed
description The title compound, 2C(20)H(29)N(2)O(5)S(+)·C(6)H(8)O(4) (2−)·4H(2)O, which was found to be optically active, is a relatively rare example of a chiral compound crystallizing in the triclinic crystal system. The dihedral angles between the phenyl rings of the cations are 60.03 (15) and 62.03 (16)°, while the C atoms of the anion are almost coplanar (r.m.s. deviation 0.085 Å) and all trans to each other. In the crystal, the components are connected by an extensive network of N—H⋯O and O—H⋯O hydrogen bonds. The sulfonamide groups link the cations into pairs via two N—H⋯O hydrogen bonds about the pseudo-inversion centre, leading to the formation of R (2) (2)(8) rings. The anions are stacked in between four cationic pairs. Pairs of water mol­ecules bridge the larger building units, forming hydrogen bonds with the remaining two O atoms of the anion.
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spelling pubmed-36295752013-04-30 Bis{(R)-1-(3-amino­sulfonyl-4-meth­oxy­phen­yl)-N-[2-(2-eth­oxy­phen­oxy)eth­yl]propan-2-aminium} adipate tetra­hydrate Ham, Zoran Meden, Anton Kasunič, Marta Acta Crystallogr Sect E Struct Rep Online Organic Papers The title compound, 2C(20)H(29)N(2)O(5)S(+)·C(6)H(8)O(4) (2−)·4H(2)O, which was found to be optically active, is a relatively rare example of a chiral compound crystallizing in the triclinic crystal system. The dihedral angles between the phenyl rings of the cations are 60.03 (15) and 62.03 (16)°, while the C atoms of the anion are almost coplanar (r.m.s. deviation 0.085 Å) and all trans to each other. In the crystal, the components are connected by an extensive network of N—H⋯O and O—H⋯O hydrogen bonds. The sulfonamide groups link the cations into pairs via two N—H⋯O hydrogen bonds about the pseudo-inversion centre, leading to the formation of R (2) (2)(8) rings. The anions are stacked in between four cationic pairs. Pairs of water mol­ecules bridge the larger building units, forming hydrogen bonds with the remaining two O atoms of the anion. International Union of Crystallography 2013-03-09 /pmc/articles/PMC3629575/ /pubmed/23634062 http://dx.doi.org/10.1107/S1600536813005254 Text en © Ham et al. 2013 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
Ham, Zoran
Meden, Anton
Kasunič, Marta
Bis{(R)-1-(3-amino­sulfonyl-4-meth­oxy­phen­yl)-N-[2-(2-eth­oxy­phen­oxy)eth­yl]propan-2-aminium} adipate tetra­hydrate
title Bis{(R)-1-(3-amino­sulfonyl-4-meth­oxy­phen­yl)-N-[2-(2-eth­oxy­phen­oxy)eth­yl]propan-2-aminium} adipate tetra­hydrate
title_full Bis{(R)-1-(3-amino­sulfonyl-4-meth­oxy­phen­yl)-N-[2-(2-eth­oxy­phen­oxy)eth­yl]propan-2-aminium} adipate tetra­hydrate
title_fullStr Bis{(R)-1-(3-amino­sulfonyl-4-meth­oxy­phen­yl)-N-[2-(2-eth­oxy­phen­oxy)eth­yl]propan-2-aminium} adipate tetra­hydrate
title_full_unstemmed Bis{(R)-1-(3-amino­sulfonyl-4-meth­oxy­phen­yl)-N-[2-(2-eth­oxy­phen­oxy)eth­yl]propan-2-aminium} adipate tetra­hydrate
title_short Bis{(R)-1-(3-amino­sulfonyl-4-meth­oxy­phen­yl)-N-[2-(2-eth­oxy­phen­oxy)eth­yl]propan-2-aminium} adipate tetra­hydrate
title_sort bis{(r)-1-(3-amino­sulfonyl-4-meth­oxy­phen­yl)-n-[2-(2-eth­oxy­phen­oxy)eth­yl]propan-2-aminium} adipate tetra­hydrate
topic Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3629575/
https://www.ncbi.nlm.nih.gov/pubmed/23634062
http://dx.doi.org/10.1107/S1600536813005254
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AT kasunicmarta bisr13aminosulfonyl4methoxyphenyln22ethoxyphenoxyethylpropan2aminiumadipatetetrahydrate