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6-Fluoro-4-oxo-4H-chromene-3-carbaldehyde
In the title compound, C(10)H(5)FO(3), the non-H atoms are essentially coplanar (r.m.s. deviation = 0.0071 Å), with the largest deviation from the mean plane [0.0203 (15) Å] being found for the ring C atom in the 2-position. In the crystal, molecules are linked into a three-dimensional architecture...
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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/PMC4011281/ https://www.ncbi.nlm.nih.gov/pubmed/24860383 http://dx.doi.org/10.1107/S1600536814008502 |
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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(5)FO(3), the non-H atoms are essentially coplanar (r.m.s. deviation = 0.0071 Å), with the largest deviation from the mean plane [0.0203 (15) Å] being found for the ring C atom in the 2-position. In the crystal, molecules are linked into a three-dimensional architecture via C—H⋯O hydrogen bonds and π–π stacking interactions between the chromone units along the a-axis direction [centroid–centroid distance between the benzene and pyran rings = 3.707 (2) Å]. |
format | Online Article Text |
id | pubmed-4011281 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2014 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-40112812014-05-23 6-Fluoro-4-oxo-4H-chromene-3-carbaldehyde Ishikawa, Yoshinobu Acta Crystallogr Sect E Struct Rep Online Organic Papers In the title compound, C(10)H(5)FO(3), the non-H atoms are essentially coplanar (r.m.s. deviation = 0.0071 Å), with the largest deviation from the mean plane [0.0203 (15) Å] being found for the ring C atom in the 2-position. In the crystal, molecules are linked into a three-dimensional architecture via C—H⋯O hydrogen bonds and π–π stacking interactions between the chromone units along the a-axis direction [centroid–centroid distance between the benzene and pyran rings = 3.707 (2) Å]. International Union of Crystallography 2014-04-18 /pmc/articles/PMC4011281/ /pubmed/24860383 http://dx.doi.org/10.1107/S1600536814008502 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-Fluoro-4-oxo-4H-chromene-3-carbaldehyde |
title | 6-Fluoro-4-oxo-4H-chromene-3-carbaldehyde |
title_full | 6-Fluoro-4-oxo-4H-chromene-3-carbaldehyde |
title_fullStr | 6-Fluoro-4-oxo-4H-chromene-3-carbaldehyde |
title_full_unstemmed | 6-Fluoro-4-oxo-4H-chromene-3-carbaldehyde |
title_short | 6-Fluoro-4-oxo-4H-chromene-3-carbaldehyde |
title_sort | 6-fluoro-4-oxo-4h-chromene-3-carbaldehyde |
topic | Organic Papers |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4011281/ https://www.ncbi.nlm.nih.gov/pubmed/24860383 http://dx.doi.org/10.1107/S1600536814008502 |
work_keys_str_mv | AT ishikawayoshinobu 6fluoro4oxo4hchromene3carbaldehyde |