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2-Amino-4-nitro­phenol–1-(2,4,6-trihy­droxy­phen­yl)ethanone (1/1)

In the title compound, C(6)H(6)N(2)O(3)·C(8)H(8)O(4), the 2-amino-4-nitro­phenol (ANP) and 1-(2,4,6-trihy­droxy­phen­yl)ethanone (THA) mol­ecules are both nearly planar, with r.m.s. deviations of 0.0630 and 0.0313 Å, respectively. The angle between the least-squares planes of THA and ANP is 48.99 (2...

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Autores principales: Kocabıyık, Can, Paşaoğlu, Hümeyra, Basılı, Taşkın, Ağar, Erbil
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2012
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3344630/
https://www.ncbi.nlm.nih.gov/pubmed/22590392
http://dx.doi.org/10.1107/S1600536812017497
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author Kocabıyık, Can
Paşaoğlu, Hümeyra
Basılı, Taşkın
Ağar, Erbil
author_facet Kocabıyık, Can
Paşaoğlu, Hümeyra
Basılı, Taşkın
Ağar, Erbil
author_sort Kocabıyık, Can
collection PubMed
description In the title compound, C(6)H(6)N(2)O(3)·C(8)H(8)O(4), the 2-amino-4-nitro­phenol (ANP) and 1-(2,4,6-trihy­droxy­phen­yl)ethanone (THA) mol­ecules are both nearly planar, with r.m.s. deviations of 0.0630 and 0.0313 Å, respectively. The angle between the least-squares planes of THA and ANP is 48.99 (2)°. In THA, an intra­molecular O—H⋯O hydrogen bond generates an S(6) ring motif. In the crystal, N—H⋯O, O—H⋯O and O—H⋯N hydrogen bonds lead to the formation of a three-dimensional network. There are also inter­molecular π–π inter­actions between the benzene rings of ANP–ANP and of THA–THA mol­ecules, with centroid–centroid distances of 3.5313 (14) and 3.8440 (16) Å, respectively. Weak C—O⋯π and N—O⋯π inter­actions also occur.
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spelling pubmed-33446302012-05-15 2-Amino-4-nitro­phenol–1-(2,4,6-trihy­droxy­phen­yl)ethanone (1/1) Kocabıyık, Can Paşaoğlu, Hümeyra Basılı, Taşkın Ağar, Erbil Acta Crystallogr Sect E Struct Rep Online Organic Papers In the title compound, C(6)H(6)N(2)O(3)·C(8)H(8)O(4), the 2-amino-4-nitro­phenol (ANP) and 1-(2,4,6-trihy­droxy­phen­yl)ethanone (THA) mol­ecules are both nearly planar, with r.m.s. deviations of 0.0630 and 0.0313 Å, respectively. The angle between the least-squares planes of THA and ANP is 48.99 (2)°. In THA, an intra­molecular O—H⋯O hydrogen bond generates an S(6) ring motif. In the crystal, N—H⋯O, O—H⋯O and O—H⋯N hydrogen bonds lead to the formation of a three-dimensional network. There are also inter­molecular π–π inter­actions between the benzene rings of ANP–ANP and of THA–THA mol­ecules, with centroid–centroid distances of 3.5313 (14) and 3.8440 (16) Å, respectively. Weak C—O⋯π and N—O⋯π inter­actions also occur. International Union of Crystallography 2012-04-25 /pmc/articles/PMC3344630/ /pubmed/22590392 http://dx.doi.org/10.1107/S1600536812017497 Text en © Kocabıyık et al. 2012 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
Kocabıyık, Can
Paşaoğlu, Hümeyra
Basılı, Taşkın
Ağar, Erbil
2-Amino-4-nitro­phenol–1-(2,4,6-trihy­droxy­phen­yl)ethanone (1/1)
title 2-Amino-4-nitro­phenol–1-(2,4,6-trihy­droxy­phen­yl)ethanone (1/1)
title_full 2-Amino-4-nitro­phenol–1-(2,4,6-trihy­droxy­phen­yl)ethanone (1/1)
title_fullStr 2-Amino-4-nitro­phenol–1-(2,4,6-trihy­droxy­phen­yl)ethanone (1/1)
title_full_unstemmed 2-Amino-4-nitro­phenol–1-(2,4,6-trihy­droxy­phen­yl)ethanone (1/1)
title_short 2-Amino-4-nitro­phenol–1-(2,4,6-trihy­droxy­phen­yl)ethanone (1/1)
title_sort 2-amino-4-nitro­phenol–1-(2,4,6-trihy­droxy­phen­yl)ethanone (1/1)
topic Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3344630/
https://www.ncbi.nlm.nih.gov/pubmed/22590392
http://dx.doi.org/10.1107/S1600536812017497
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