Information card for entry 4106897

Structure parameters

• Formula: C24 H31 N O
• Calculated formula: C24 H31 N O
• Title of publication: Catalytic Asymmetric γ-Alkylation of Carbonyl Compounds via Stereoconvergent Suzuki Cross-Couplings
• Authors of publication: Susan L. Zultanski; Gregory C. Fu
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2011
• Journal volume: 133
• Pages of publication: 15362 - 15364
• a: 17.5701 ± 0.0005 Å
• b: 5.6668 ± 0.0002 Å
• c: 20.4694 ± 0.0007 Å
• α: 90°
• β: 96.082 ± 0.002°
• γ: 90°
• Cell volume: 2026.59 ± 0.12 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 4
• Space group number: 5
• Hermann-Mauguin space group symbol: C 1 2 1
• Hall space group symbol: C 2y
• Residual factor for all reflections: 0.0506
• Residual factor for significantly intense reflections: 0.0476
• Weighted residual factors for significantly intense reflections: 0.1306
• Weighted residual factors for all reflections included in the refinement: 0.1328
• Goodness-of-fit parameter for all reflections included in the refinement: 1.054
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No