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6-Iodo-4-oxo-4H-chromene-3-carbaldehyde
In the title compound, C(10)H(5)IO(3), an iodinated 3-formylchromone derivative, the non-H atoms are essentially coplanar (r.m.s. deviation = 0.0259 Å), with the largest deviation from the least-squares plane [0.056 (5) Å] being found for the formyl O atom. In the crystal, molecules are linked thr...
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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/PMC4120610/ https://www.ncbi.nlm.nih.gov/pubmed/25161541 http://dx.doi.org/10.1107/S1600536814012471 |
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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)IO(3), an iodinated 3-formylchromone derivative, the non-H atoms are essentially coplanar (r.m.s. deviation = 0.0259 Å), with the largest deviation from the least-squares plane [0.056 (5) Å] being found for the formyl O atom. In the crystal, molecules are linked through I⋯O halogen bonds [I⋯O = 3.245 (4) Å, C—I⋯O = 165.95 (13) and C=O⋯I = 169.7 (4)°] along [101]. The supramolecular chains are assembled into layers via π–π stacking interactions along the b axis [shortest centroid–centroid distance between the pyran and benzene rings = 3.558 (3) Å]. |
format | Online Article Text |
id | pubmed-4120610 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2014 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-41206102014-08-26 6-Iodo-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)IO(3), an iodinated 3-formylchromone derivative, the non-H atoms are essentially coplanar (r.m.s. deviation = 0.0259 Å), with the largest deviation from the least-squares plane [0.056 (5) Å] being found for the formyl O atom. In the crystal, molecules are linked through I⋯O halogen bonds [I⋯O = 3.245 (4) Å, C—I⋯O = 165.95 (13) and C=O⋯I = 169.7 (4)°] along [101]. The supramolecular chains are assembled into layers via π–π stacking interactions along the b axis [shortest centroid–centroid distance between the pyran and benzene rings = 3.558 (3) Å]. International Union of Crystallography 2014-06-04 /pmc/articles/PMC4120610/ /pubmed/25161541 http://dx.doi.org/10.1107/S1600536814012471 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-Iodo-4-oxo-4H-chromene-3-carbaldehyde |
title | 6-Iodo-4-oxo-4H-chromene-3-carbaldehyde |
title_full | 6-Iodo-4-oxo-4H-chromene-3-carbaldehyde |
title_fullStr | 6-Iodo-4-oxo-4H-chromene-3-carbaldehyde |
title_full_unstemmed | 6-Iodo-4-oxo-4H-chromene-3-carbaldehyde |
title_short | 6-Iodo-4-oxo-4H-chromene-3-carbaldehyde |
title_sort | 6-iodo-4-oxo-4h-chromene-3-carbaldehyde |
topic | Organic Papers |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4120610/ https://www.ncbi.nlm.nih.gov/pubmed/25161541 http://dx.doi.org/10.1107/S1600536814012471 |
work_keys_str_mv | AT ishikawayoshinobu 6iodo4oxo4hchromene3carbaldehyde |