Information card for entry 4106521

Structure parameters

• Formula: C34 H51 N O7
• Calculated formula: C34 H51 N O7
• Title of publication: Application of a New Chiral Phosphepine to the Catalytic Asymmetric Synthesis of Highly Functionalized Cyclopentenes That Bear an Array of Heteroatom-Substituted Quaternary Stereocenters
• Authors of publication: Yuji Fujiwara; Gregory C. Fu
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2011
• Journal volume: 133
• Pages of publication: 12293 - 12297
• a: 9.5202 ± 0.0003 Å
• b: 10.1753 ± 0.0003 Å
• c: 16.8674 ± 0.0005 Å
• α: 90°
• β: 94.524 ± 0.002°
• γ: 90°
• Cell volume: 1628.87 ± 0.09 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 4
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.0555
• Residual factor for significantly intense reflections: 0.0511
• Weighted residual factors for significantly intense reflections: 0.1396
• Weighted residual factors for all reflections included in the refinement: 0.1448
• Goodness-of-fit parameter for all reflections included in the refinement: 1.029
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No