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Methyl 2-(5-iodo-7-methyl-3-methylsulfinyl-1-benzofuran-2-yl)acetate
There are two symmetry-independent molecules in the asymmetric unit of the title compound, C(13)H(13)IO(4)S. In each molecule, the O atom and the methyl group of the methylsulfinyl substituent lie on opposite sides of the plane of the benzofuran fragment. The crystal structure is stabilized by ar...
Autores principales: | , , , |
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Formato: | Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2009
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2969819/ https://www.ncbi.nlm.nih.gov/pubmed/21583107 http://dx.doi.org/10.1107/S1600536809016298 |
Sumario: | There are two symmetry-independent molecules in the asymmetric unit of the title compound, C(13)H(13)IO(4)S. In each molecule, the O atom and the methyl group of the methylsulfinyl substituent lie on opposite sides of the plane of the benzofuran fragment. The crystal structure is stabilized by aromatic π–π interactions between the benzene and furan ring [centroid–centroid distance = 3.866 (7) Å], and by intermolecular C—H⋯π interactions and a sulfinyl–sulfinyl interaction [S⋯O = 3.025 (4) Å]. The crystal structure also exhibits weak intermolecular C—H⋯O hydrogen bonds and two different I⋯O halogen bonds. |
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