3,3′-Dinitro­bis­phenol A

The title compound [systematic name: 2,2′-dinitro-4,4′-(propane-2,2-di­yl)diphenol], C(15)H(14)N(2)O(6), crystallizes with two mol­ecules in the asymmetric unit. Both have a trans conformation for their OH groups, and in each, the two aromatic rings are nearly orthogonal, with dihedral angles of 88....

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Autores principales: Babu, Sainath, Pathak, Chintan, Uppu, Satvika, Jones, Conrad, Fronczek, Frank R., Uppu, Rao M.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2011
Materias:
Organic Papers
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3201564/
https://www.ncbi.nlm.nih.gov/pubmed/22065402
http://dx.doi.org/10.1107/S1600536811035458
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author Babu, Sainath
Pathak, Chintan
Uppu, Satvika
Jones, Conrad
Fronczek, Frank R.
Uppu, Rao M.
author_facet Babu, Sainath
Pathak, Chintan
Uppu, Satvika
Jones, Conrad
Fronczek, Frank R.
Uppu, Rao M.
author_sort Babu, Sainath
collection PubMed
description The title compound [systematic name: 2,2′-dinitro-4,4′-(propane-2,2-di­yl)diphenol], C(15)H(14)N(2)O(6), crystallizes with two mol­ecules in the asymmetric unit. Both have a trans conformation for their OH groups, and in each, the two aromatic rings are nearly orthogonal, with dihedral angles of 88.30 (3) and 89.62 (2)°. The nitro groups are nearly in the planes of their attached benzene rings, with C—C—N—O torsion angles in the range 1.21 (17)–4.06 (17)°, and they each accept an intra­molecular O—H⋯O hydrogen bond from their adjacent OH groups. One of the OH groups also forms a weak inter­molecular O—H⋯O hydrogen bond.
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spelling pubmed-32015642011-11-06 3,3′-Dinitro­bis­phenol A Babu, Sainath Pathak, Chintan Uppu, Satvika Jones, Conrad Fronczek, Frank R. Uppu, Rao M. Acta Crystallogr Sect E Struct Rep Online Organic Papers The title compound [systematic name: 2,2′-dinitro-4,4′-(propane-2,2-di­yl)diphenol], C(15)H(14)N(2)O(6), crystallizes with two mol­ecules in the asymmetric unit. Both have a trans conformation for their OH groups, and in each, the two aromatic rings are nearly orthogonal, with dihedral angles of 88.30 (3) and 89.62 (2)°. The nitro groups are nearly in the planes of their attached benzene rings, with C—C—N—O torsion angles in the range 1.21 (17)–4.06 (17)°, and they each accept an intra­molecular O—H⋯O hydrogen bond from their adjacent OH groups. One of the OH groups also forms a weak inter­molecular O—H⋯O hydrogen bond. International Union of Crystallography 2011-09-03 /pmc/articles/PMC3201564/ /pubmed/22065402 http://dx.doi.org/10.1107/S1600536811035458 Text en © Babu et al. 2011 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
Babu, Sainath
Pathak, Chintan
Uppu, Satvika
Jones, Conrad
Fronczek, Frank R.
Uppu, Rao M.
3,3′-Dinitro­bis­phenol A
title 3,3′-Dinitro­bis­phenol A
title_full 3,3′-Dinitro­bis­phenol A
title_fullStr 3,3′-Dinitro­bis­phenol A
title_full_unstemmed 3,3′-Dinitro­bis­phenol A
title_short 3,3′-Dinitro­bis­phenol A
title_sort 3,3′-dinitro­bis­phenol a
topic Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3201564/
https://www.ncbi.nlm.nih.gov/pubmed/22065402
http://dx.doi.org/10.1107/S1600536811035458
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AT uppusatvika 33dinitrobisphenola
AT jonesconrad 33dinitrobisphenola
AT fronczekfrankr 33dinitrobisphenola
AT uppuraom 33dinitrobisphenola

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