Information card for entry 1567702

Structure parameters

• Formula: C24 H23 N O3
• Calculated formula: C24 H23 N O3
• Title of publication: Palladium-catalyzed intramolecular enantioselective C(sp3)–H insertion of donor/donor carbenes
• Authors of publication: Li, Wendeng; Zhang, He; Chen, Kai; Jiang, Huanfeng; Sun, Jianwei; Zhu, Shifa
• Journal of publication: Chemical Science
• Year of publication: 2022
• Journal volume: 13
• Journal issue: 42
• Pages of publication: 12396 - 12402
• a: 7.9494 ± 0.0001 Å
• b: 10.2838 ± 0.0001 Å
• c: 24.4594 ± 0.0003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1999.56 ± 0.04 ų
• Cell temperature: 150 ± 0.1 K
• Ambient diffraction temperature: 150 ± 0.1 K
• Number of distinct elements: 4
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0369
• Residual factor for significantly intense reflections: 0.0349
• Weighted residual factors for significantly intense reflections: 0.0923
• Weighted residual factors for all reflections included in the refinement: 0.0935
• Goodness-of-fit parameter for all reflections included in the refinement: 0.986
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No