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2,2′-(Disulfanediyl)dibenzoic acid–N,N′-bis(3-pyridylmethyl)ethanediamide (1/1)
The asymmetric unit of the title cocrystal, C(14)H(14)N(4)O(2)·C(14)H(10)O(4)S(2), comprises a twisted 2,2′-(disulfanediyl)dibenzoic acid molecule [dihedral angle between the benzene rings = 76.35 (10)°] and a U-shaped N,N′-bis(3-pyridylmethyl)ethanediamide molecule with the pyridyl groups lyi...
Autores principales: | , , , |
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Formato: | Texto |
Lenguaje: | English |
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International Union of Crystallography
2010
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2983345/ https://www.ncbi.nlm.nih.gov/pubmed/21587570 http://dx.doi.org/10.1107/S1600536810036494 |
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author | Arman, Hadi D. Miller, Tyler Poplaukhin, Pavel Tiekink, Edward R. T. |
author_facet | Arman, Hadi D. Miller, Tyler Poplaukhin, Pavel Tiekink, Edward R. T. |
author_sort | Arman, Hadi D. |
collection | PubMed |
description | The asymmetric unit of the title cocrystal, C(14)H(14)N(4)O(2)·C(14)H(10)O(4)S(2), comprises a twisted 2,2′-(disulfanediyl)dibenzoic acid molecule [dihedral angle between the benzene rings = 76.35 (10)°] and a U-shaped N,N′-bis(3-pyridylmethyl)ethanediamide molecule with the pyridyl groups lying to the same side of the central diamide moiety [C—C—C—N = 113.8 (2) and −117.6 (2)°]. The latter aggregate into supramolecular tapes propagating along the a axis via centrosymmetric eight-membered amide {⋯OCNH}(2) synthons. Intramolecular N—H⋯O hydrogen bonds are observed. The 2,2′-(disulfanediyl)dibenzoic acid molecules form carboxyl–pyridine O—H⋯N hydrogen bonds, bridging a pyridine residue below the plane of the tape and one above the plane with two intervening N,N′-bis(3-pyridylmethyl)ethanediamide molecules. The supramolecular chains are consolidated in the crystal packing by C—H⋯O contacts. An intermolecular C—H⋯S interaction also occurs. |
format | Text |
id | pubmed-2983345 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2010 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-29833452010-12-30 2,2′-(Disulfanediyl)dibenzoic acid–N,N′-bis(3-pyridylmethyl)ethanediamide (1/1) Arman, Hadi D. Miller, Tyler Poplaukhin, Pavel Tiekink, Edward R. T. Acta Crystallogr Sect E Struct Rep Online Organic Papers The asymmetric unit of the title cocrystal, C(14)H(14)N(4)O(2)·C(14)H(10)O(4)S(2), comprises a twisted 2,2′-(disulfanediyl)dibenzoic acid molecule [dihedral angle between the benzene rings = 76.35 (10)°] and a U-shaped N,N′-bis(3-pyridylmethyl)ethanediamide molecule with the pyridyl groups lying to the same side of the central diamide moiety [C—C—C—N = 113.8 (2) and −117.6 (2)°]. The latter aggregate into supramolecular tapes propagating along the a axis via centrosymmetric eight-membered amide {⋯OCNH}(2) synthons. Intramolecular N—H⋯O hydrogen bonds are observed. The 2,2′-(disulfanediyl)dibenzoic acid molecules form carboxyl–pyridine O—H⋯N hydrogen bonds, bridging a pyridine residue below the plane of the tape and one above the plane with two intervening N,N′-bis(3-pyridylmethyl)ethanediamide molecules. The supramolecular chains are consolidated in the crystal packing by C—H⋯O contacts. An intermolecular C—H⋯S interaction also occurs. International Union of Crystallography 2010-09-18 /pmc/articles/PMC2983345/ /pubmed/21587570 http://dx.doi.org/10.1107/S1600536810036494 Text en © Arman et al. 2010 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 Arman, Hadi D. Miller, Tyler Poplaukhin, Pavel Tiekink, Edward R. T. 2,2′-(Disulfanediyl)dibenzoic acid–N,N′-bis(3-pyridylmethyl)ethanediamide (1/1) |
title | 2,2′-(Disulfanediyl)dibenzoic acid–N,N′-bis(3-pyridylmethyl)ethanediamide (1/1) |
title_full | 2,2′-(Disulfanediyl)dibenzoic acid–N,N′-bis(3-pyridylmethyl)ethanediamide (1/1) |
title_fullStr | 2,2′-(Disulfanediyl)dibenzoic acid–N,N′-bis(3-pyridylmethyl)ethanediamide (1/1) |
title_full_unstemmed | 2,2′-(Disulfanediyl)dibenzoic acid–N,N′-bis(3-pyridylmethyl)ethanediamide (1/1) |
title_short | 2,2′-(Disulfanediyl)dibenzoic acid–N,N′-bis(3-pyridylmethyl)ethanediamide (1/1) |
title_sort | 2,2′-(disulfanediyl)dibenzoic acid–n,n′-bis(3-pyridylmethyl)ethanediamide (1/1) |
topic | Organic Papers |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2983345/ https://www.ncbi.nlm.nih.gov/pubmed/21587570 http://dx.doi.org/10.1107/S1600536810036494 |
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