6-Bromo-4-oxo-4H-chromene-3-carbaldehyde
In the title compound, C10H5BrO3, a brominated 3-formylchromone derivative, the non-H atoms are essentially coplanar (r.m.s. deviation = 0.0420 Å), with the largest deviation from its mean plane [0.109 (2) Å] being found for the ring-bound carbonyl O atom. In the crystal, molecules are linked throug...
Saved in:
| Published in | Acta crystallographica. Section E, Structure reports online Vol. 70; no. 5; p. o555 |
|---|---|
| Main Author | |
| Format | Journal Article |
| Language | English |
| Published |
International Union of Crystallography
01.05.2014
|
| Online Access | Get full text |
Cover
Loading…
| Summary: | In the title compound, C10H5BrO3, a brominated 3-formylchromone derivative, the non-H atoms are essentially coplanar (r.m.s. deviation = 0.0420 Å), with the largest deviation from its mean plane [0.109 (2) Å] being found for the ring-bound carbonyl O atom. In the crystal, molecules are linked through halogen bonds [Br...O = 3.191 (2) Å, C—Br...O = 167.32 (10)° and C=O...Br = 168.4 (2)°] along [101]. Molecules are assembled into layers parallel to (101) via π–π stacking interactions along the b axis [shortest centroid–centroid distance between the pyran and benzene rings = 3.495 (2) Å]. |
|---|---|
| ISSN: | 1600-5368 1600-5368 |
| DOI: | 10.1107/S160053681400796X |