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5-Chloro-6-hydroxy-7,8-dimethylchroman-2-one
In the title molecule, C(11)H(11)ClO(3), the fused pyran ring adopts a half-chair conformation. In the crystal, intermolecular O—H⋯O hydrogen bonds link molecules into chains along [100]. These chains are interconnected by weak intermolecular C—H⋯O contacts which generate R (2) (2)(8) ring moti...
Autores principales: | , , , , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2011
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3213581/ https://www.ncbi.nlm.nih.gov/pubmed/22091158 http://dx.doi.org/10.1107/S1600536811029345 |
Sumario: | In the title molecule, C(11)H(11)ClO(3), the fused pyran ring adopts a half-chair conformation. In the crystal, intermolecular O—H⋯O hydrogen bonds link molecules into chains along [100]. These chains are interconnected by weak intermolecular C—H⋯O contacts which generate R (2) (2)(8) ring motifs, forming sheets parallel to (001). Tetragonal symmetry generates an equivalent motif along b. Furthermore, the sheets are linked along the c axis by offset π–π stacking interactions involving the benzene rings of adjacent molecules [with centroid–centroid distances of 3.839 (2) Å], together with an additional weak C—H⋯O hydrogen bond, resulting in an overall three-dimensional network. |
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