Information card for entry 1506468

Structure parameters

• Formula: C17 H15 N O4
• Calculated formula: C17 H15 N O4
• Title of publication: One-pot multistep synthesis of 4-acetoxy-2-amino-3-arylbenzofurans from 1-aryl-2-nitroethylenes and cyclohexane-1,3-diones.
• Authors of publication: Ishikawa, Teruhiko; Miyahara, Tadashi; Asakura, Mami; Higuchi, Shuichi; Miyauchi, Yayoi; Saito, Seiki
• Journal of publication: Organic letters
• Year of publication: 2005
• Journal volume: 7
• Journal issue: 7
• Pages of publication: 1211 - 1214
• a: 7.57 ± 0.02 Å
• b: 9.27 ± 0.02 Å
• c: 11.24 ± 0.03 Å
• α: 107.1 ± 0.1°
• β: 102 ± 0.1°
• γ: 99.6 ± 0.1°
• Cell volume: 715 ± 3 ų
• Cell temperature: 296.1 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for significantly intense reflections: 0.039
• Weighted residual factors for all reflections included in the refinement: 0.037
• Goodness-of-fit parameter for all reflections included in the refinement: 1.812
• Diffraction radiation wavelength: 1.5419 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No