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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...

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Detalles Bibliográficos
Autores principales: Cameron, Scott A., Goswami, Shailesh K., Hanton, Lyall R., McAdam, C. John, Moratti, Stephen C., Simpson, Jim
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2011
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
Descripción
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.