Information card for entry 7151746

Structure parameters

• Formula: C24 H17 N2 O3
• Calculated formula: C24 H17 N2 O3
• Title of publication: Stereoselective control in the Staudinger reactions involving monosubstituted ketenes with electron acceptor substituents: experimental investigation and theoretical rationalization.
• Authors of publication: Qi, Hengzhen; Li, Xinyao; Xu, Jiaxi
• Journal of publication: Organic & biomolecular chemistry
• Year of publication: 2011
• Journal volume: 9
• Journal issue: 8
• Pages of publication: 2702 - 2714
• a: 16.927 ± 0.003 Å
• b: 12.667 ± 0.003 Å
• c: 18.063 ± 0.004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3873 ± 1.4 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• Space group number: 33
• Hermann-Mauguin space group symbol: P n a 21
• Hall space group symbol: P 2c -2n
• Residual factor for all reflections: 0.1151
• Residual factor for significantly intense reflections: 0.057
• Weighted residual factors for significantly intense reflections: 0.1081
• Weighted residual factors for all reflections included in the refinement: 0.1233
• Goodness-of-fit parameter for all reflections included in the refinement: 0.977
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No