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6,8-Dibromo-4-oxo-4H-chromene-3-carbaldehyde
In the title compound, C(10)H(4)Br(2)O(3), the atoms of the 6,8-dibromochromone unit are essentially coplanar [largest deviation from the mean planes = 0.1109 (3) Å] and the formyl group is twisted slightly with respect to the attached ring [C—C—C—O torsion angles = 11.5 (4) and −168.9 (3)°]. In t...
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Formato: | Online Artículo Texto |
Lenguaje: | English |
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International Union of Crystallography
2014
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Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3998586/ https://www.ncbi.nlm.nih.gov/pubmed/24826144 http://dx.doi.org/10.1107/S1600536814005327 |
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author | Ishikawa, Yoshinobu |
author_facet | Ishikawa, Yoshinobu |
author_sort | Ishikawa, Yoshinobu |
collection | PubMed |
description | In the title compound, C(10)H(4)Br(2)O(3), the atoms of the 6,8-dibromochromone unit are essentially coplanar [largest deviation from the mean planes = 0.1109 (3) Å] and the formyl group is twisted slightly with respect to the attached ring [C—C—C—O torsion angles = 11.5 (4) and −168.9 (3)°]. In the crystal, molecules are linked to each other through halogen bonds [Br⋯O = 3.118 (2) Å, C—Br⋯O = 162.37 (8) and C=O⋯Br = 140.20 (15)°]. The molecules are further assembled via π–π stacking interactions [centroid–centroid distance = 3.850 (2) Å]. |
format | Online Article Text |
id | pubmed-3998586 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2014 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-39985862014-05-13 6,8-Dibromo-4-oxo-4H-chromene-3-carbaldehyde Ishikawa, Yoshinobu Acta Crystallogr Sect E Struct Rep Online Organic Papers In the title compound, C(10)H(4)Br(2)O(3), the atoms of the 6,8-dibromochromone unit are essentially coplanar [largest deviation from the mean planes = 0.1109 (3) Å] and the formyl group is twisted slightly with respect to the attached ring [C—C—C—O torsion angles = 11.5 (4) and −168.9 (3)°]. In the crystal, molecules are linked to each other through halogen bonds [Br⋯O = 3.118 (2) Å, C—Br⋯O = 162.37 (8) and C=O⋯Br = 140.20 (15)°]. The molecules are further assembled via π–π stacking interactions [centroid–centroid distance = 3.850 (2) Å]. International Union of Crystallography 2014-03-15 /pmc/articles/PMC3998586/ /pubmed/24826144 http://dx.doi.org/10.1107/S1600536814005327 Text en © Yoshinobu Ishikawa 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 | Organic Papers Ishikawa, Yoshinobu 6,8-Dibromo-4-oxo-4H-chromene-3-carbaldehyde |
title | 6,8-Dibromo-4-oxo-4H-chromene-3-carbaldehyde |
title_full | 6,8-Dibromo-4-oxo-4H-chromene-3-carbaldehyde |
title_fullStr | 6,8-Dibromo-4-oxo-4H-chromene-3-carbaldehyde |
title_full_unstemmed | 6,8-Dibromo-4-oxo-4H-chromene-3-carbaldehyde |
title_short | 6,8-Dibromo-4-oxo-4H-chromene-3-carbaldehyde |
title_sort | 6,8-dibromo-4-oxo-4h-chromene-3-carbaldehyde |
topic | Organic Papers |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3998586/ https://www.ncbi.nlm.nih.gov/pubmed/24826144 http://dx.doi.org/10.1107/S1600536814005327 |
work_keys_str_mv | AT ishikawayoshinobu 68dibromo4oxo4hchromene3carbaldehyde |