Information card for entry 7156877

Structure parameters

• Formula: C15 H11 N O3
• Calculated formula: C15 H11 N O3
• Title of publication: Copper-catalyzed coupling of anthranils and α-keto acids: direct synthesis of α-ketoamides.
• Authors of publication: Li, Ping-Gui; Zhu, Hao; Fan, Min; Yan, Cheng; Shi, Kai; Chi, Xi-Wen; Zou, Liang-Hua
• Journal of publication: Organic & biomolecular chemistry
• Year of publication: 2019
• Journal volume: 17
• Journal issue: 24
• Pages of publication: 5902 - 5907
• a: 12.8593 ± 0.0008 Å
• b: 14.1412 ± 0.001 Å
• c: 6.7109 ± 0.0005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1220.35 ± 0.15 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 4
• Space group number: 29
• Hermann-Mauguin space group symbol: P c a 21
• Hall space group symbol: P 2c -2ac
• Residual factor for all reflections: 0.0343
• Residual factor for significantly intense reflections: 0.031
• Weighted residual factors for significantly intense reflections: 0.0792
• Weighted residual factors for all reflections included in the refinement: 0.0812
• Goodness-of-fit parameter for all reflections included in the refinement: 1.097
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No