Information card for entry 4120892

Structure parameters

• Formula: C36 H38 N2 O4
• Calculated formula: C36 H38 N2 O4
• Title of publication: Rh2(R-TPCP)4- Catalyzed Enantioselective [3+2]-Cycloaddition between Nitrones and Vinyldiazoacetates
• Authors of publication: Changming Qin; Huw M. L. Davies
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2013
• Journal volume: 135
• Pages of publication: 14516 - 14519
• a: 6.577 ± 0.0002 Å
• b: 13.6444 ± 0.0005 Å
• c: 8.0893 ± 0.0003 Å
• α: 90°
• β: 91.519 ± 0.003°
• γ: 90°
• Cell volume: 725.67 ± 0.04 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 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: 0.0237
• Residual factor for significantly intense reflections: 0.0234
• Weighted residual factors for significantly intense reflections: 0.0596
• Weighted residual factors for all reflections included in the refinement: 0.0599
• Goodness-of-fit parameter for all reflections included in the refinement: 1.078
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes