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Crystal structure of 4,4′-(disulfanediyl)dibutanoic acid–4,4′-bipyridine (1/1)

4,4′-(Disulfanediyl)dibutanoic acid (dtba) and 4,4′-bipyridine (4,4′-bpy) crystallize in an 1:1 ratio, leading to the title co-crystal with composition C(8)H(14)O(4)S(2)·C(10)H(8)N(2). A distinctive feature of the crystal structure is the geometry of the dtba moiety, which appears to be stretched [w...

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Detalles Bibliográficos
Autores principales: Atria, Ana María, Garland, Maria Teresa, Baggio, Ricardo
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2014
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4186179/
https://www.ncbi.nlm.nih.gov/pubmed/25309167
http://dx.doi.org/10.1107/S1600536814018558
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author Atria, Ana María
Garland, Maria Teresa
Baggio, Ricardo
author_facet Atria, Ana María
Garland, Maria Teresa
Baggio, Ricardo
author_sort Atria, Ana María
collection PubMed
description 4,4′-(Disulfanediyl)dibutanoic acid (dtba) and 4,4′-bipyridine (4,4′-bpy) crystallize in an 1:1 ratio, leading to the title co-crystal with composition C(8)H(14)O(4)S(2)·C(10)H(8)N(2). A distinctive feature of the crystal structure is the geometry of the dtba moiety, which appears to be stretched [with a 9.98 (1) Å span between outermost carbons] and acts as an hydrogen-bonding connector, forming linear chains along [-211] with the 4,4′-bpy moiety by way of O—H⋯N hydrogen bonds and C—H⋯O interactions. The influence of the mol­ecular shape on the hydrogen-bonding pattern is analysed by comparing the title compound and two other 4,4′-bpy co-crystals with closely related mol­ecules of similar formulation but different geometry, showing the way in which this correlates with the packing arrangement.
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spelling pubmed-41861792014-10-12 Crystal structure of 4,4′-(disulfanediyl)dibutanoic acid–4,4′-bipyridine (1/1) Atria, Ana María Garland, Maria Teresa Baggio, Ricardo Acta Crystallogr Sect E Struct Rep Online Research Communications 4,4′-(Disulfanediyl)dibutanoic acid (dtba) and 4,4′-bipyridine (4,4′-bpy) crystallize in an 1:1 ratio, leading to the title co-crystal with composition C(8)H(14)O(4)S(2)·C(10)H(8)N(2). A distinctive feature of the crystal structure is the geometry of the dtba moiety, which appears to be stretched [with a 9.98 (1) Å span between outermost carbons] and acts as an hydrogen-bonding connector, forming linear chains along [-211] with the 4,4′-bpy moiety by way of O—H⋯N hydrogen bonds and C—H⋯O interactions. The influence of the mol­ecular shape on the hydrogen-bonding pattern is analysed by comparing the title compound and two other 4,4′-bpy co-crystals with closely related mol­ecules of similar formulation but different geometry, showing the way in which this correlates with the packing arrangement. International Union of Crystallography 2014-08-30 /pmc/articles/PMC4186179/ /pubmed/25309167 http://dx.doi.org/10.1107/S1600536814018558 Text en © Atria 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 Research Communications
Atria, Ana María
Garland, Maria Teresa
Baggio, Ricardo
Crystal structure of 4,4′-(disulfanediyl)dibutanoic acid–4,4′-bipyridine (1/1)
title Crystal structure of 4,4′-(disulfanediyl)dibutanoic acid–4,4′-bipyridine (1/1)
title_full Crystal structure of 4,4′-(disulfanediyl)dibutanoic acid–4,4′-bipyridine (1/1)
title_fullStr Crystal structure of 4,4′-(disulfanediyl)dibutanoic acid–4,4′-bipyridine (1/1)
title_full_unstemmed Crystal structure of 4,4′-(disulfanediyl)dibutanoic acid–4,4′-bipyridine (1/1)
title_short Crystal structure of 4,4′-(disulfanediyl)dibutanoic acid–4,4′-bipyridine (1/1)
title_sort crystal structure of 4,4′-(disulfanediyl)dibutanoic acid–4,4′-bipyridine (1/1)
topic Research Communications
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4186179/
https://www.ncbi.nlm.nih.gov/pubmed/25309167
http://dx.doi.org/10.1107/S1600536814018558
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