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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...
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Formato: | Texto |
Lenguaje: | English |
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International Union of Crystallography
2008
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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 |
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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 |