13 research outputs found

    5-Cyano-1,3-phenylene diacetate

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    In the title molecule, C11H9NO4, the two acetoxy groups are twisted from the plane of the benzene ring by 67.89 (4) and 53.30 (5)°. Both carbonyl groups are on the same side of the aromatic ring. In the crystal, weak C—H...O hydrogen bonds link molecules into layers parallel to the ac plane. The crystal packing exhibits π–π interactions between the aromatic rings, indicated by a short intercentroid distance of 3.767 (3) Å

    5-Cyano-1,3-phenylene diacetate

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    This article discusses 5-cyano-1,3-phenylene diacetate

    Comment on “Structural Determinants of Drug Partitioning in Surrogates of Phosphatidylcholine Bilayer Strata”

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    This article gives comment to a previous article published in 'Molecular Pharmaceuticals' titled, "Structural Determinants of Drug Partitioning in Surrogates of Phosphatidylcholine Bilayer Strata.

    5-Cyano-1,3-phenylene diacetate

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    Key indicators: single-crystal X-ray study; T = 200 K; mean (C-C) = 0.002 Å; R factor = 0.031; wR factor = 0.092; data-to-parameter ratio = 15.8. In the title molecule, C 11 H 9 NO 4 , the two acetoxy groups are twisted from the plane of the benzene ring by 67.89 (4) and 53.30 (5) . Both carbonyl groups are on the same side of the aromatic ring. In the crystal, weak C-HÁ Á ÁO hydrogen bonds link molecules into layers parallel to the ac plane. The crystal packing exhibits -interactions between the aromatic rings, indicated by a short intercentroid distance of 3.767 (3) Å . Related literatur
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