Cargando…

2,2′-Dinitro-5,5′-dithio­dibenzoic acid

In the title compound, C(14)H(8)N(2)O(8)S(2), the asymmetric unit contains two independent 2,2′-dinitro-5,5′-dithio­dibenzoic acid (Dina) mol­ecules with roughly the same conformation. In the crystal structure, strong inter­molecular O—H⋯O hydrogen bonds link the organic mol­ecules into a one-dimens...

Descripción completa

Detalles Bibliográficos
Autor principal: Wang, Li-Jin
Formato: Texto
Lenguaje:English
Publicado: International Union of Crystallography 2008
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2959743/
https://www.ncbi.nlm.nih.gov/pubmed/21580919
http://dx.doi.org/10.1107/S1600536808031620
_version_ 1782188572806217728
author Wang, Li-Jin
author_facet Wang, Li-Jin
author_sort Wang, Li-Jin
collection PubMed
description In the title compound, C(14)H(8)N(2)O(8)S(2), the asymmetric unit contains two independent 2,2′-dinitro-5,5′-dithio­dibenzoic acid (Dina) mol­ecules with roughly the same conformation. In the crystal structure, strong inter­molecular O—H⋯O hydrogen bonds link the organic mol­ecules into a one-dimensional zigzag chain along the a axis. The dihedral angles between the two aromatic rings [109.3 (2) and 103.1 (3)°] are larger than that (88.95°) observed in a structure of the compound with a solvent water mol­ecule [Shefter & Kalman (1969), J. Chem. Soc. D, p. 1027]. Such a difference may be explained by the occurrence of O—H⋯O hydrogen bonds involving the water mol­ecule in the previously reported structure.
format Text
id pubmed-2959743
institution National Center for Biotechnology Information
language English
publishDate 2008
publisher International Union of Crystallography
record_format MEDLINE/PubMed
spelling pubmed-29597432010-12-30 2,2′-Dinitro-5,5′-dithio­dibenzoic acid Wang, Li-Jin Acta Crystallogr Sect E Struct Rep Online Organic Papers In the title compound, C(14)H(8)N(2)O(8)S(2), the asymmetric unit contains two independent 2,2′-dinitro-5,5′-dithio­dibenzoic acid (Dina) mol­ecules with roughly the same conformation. In the crystal structure, strong inter­molecular O—H⋯O hydrogen bonds link the organic mol­ecules into a one-dimensional zigzag chain along the a axis. The dihedral angles between the two aromatic rings [109.3 (2) and 103.1 (3)°] are larger than that (88.95°) observed in a structure of the compound with a solvent water mol­ecule [Shefter & Kalman (1969), J. Chem. Soc. D, p. 1027]. Such a difference may be explained by the occurrence of O—H⋯O hydrogen bonds involving the water mol­ecule in the previously reported structure. International Union of Crystallography 2008-10-04 /pmc/articles/PMC2959743/ /pubmed/21580919 http://dx.doi.org/10.1107/S1600536808031620 Text en © Wang 2008 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
Wang, Li-Jin
2,2′-Dinitro-5,5′-dithio­dibenzoic acid
title 2,2′-Dinitro-5,5′-dithio­dibenzoic acid
title_full 2,2′-Dinitro-5,5′-dithio­dibenzoic acid
title_fullStr 2,2′-Dinitro-5,5′-dithio­dibenzoic acid
title_full_unstemmed 2,2′-Dinitro-5,5′-dithio­dibenzoic acid
title_short 2,2′-Dinitro-5,5′-dithio­dibenzoic acid
title_sort 2,2′-dinitro-5,5′-dithio­dibenzoic acid
topic Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2959743/
https://www.ncbi.nlm.nih.gov/pubmed/21580919
http://dx.doi.org/10.1107/S1600536808031620
work_keys_str_mv AT wanglijin 22dinitro55dithiodibenzoicacid