Information card for entry 7123119

Structure parameters

• Formula: C26 H29 N O3
• Calculated formula: C26 H29 N O3
• Title of publication: Palladium-Catalyzed Formal Insertion of Carbenoids into N,O-Aminals: Direct Access to α-Alkoxy-β-Amino Acid Esters
• Authors of publication: Huang, Hanmin; Wang, Wenhui
• Journal of publication: Chemical Communications
• Year of publication: 2019
• a: 7.3295 ± 0.0001 Å
• b: 15.2508 ± 0.0002 Å
• c: 20.5674 ± 0.0002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2299.04 ± 0.05 ų
• Cell temperature: 291 ± 2 K
• Ambient diffraction temperature: 291 ± 2 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: 0.0312
• Residual factor for significantly intense reflections: 0.0299
• Weighted residual factors for significantly intense reflections: 0.0876
• Weighted residual factors for all reflections included in the refinement: 0.0893
• Goodness-of-fit parameter for all reflections included in the refinement: 1.026
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No