Information card for entry 4129498

Structure parameters

• Formula: C23 H20 N O2 P
• Calculated formula: C23 H20 N O2 P
• SMILES: P12Oc3c(C(N2[C@H]2CCCc4ccccc24)c2c(O1)cccc2)cccc3
• Title of publication: Rhodium-Catalyzed Asymmetric 1,4-Addition of α,β-Unsaturated Imino Esters Using Chiral Bicyclic Bridgehead Phosphoramidite Ligands.
• Authors of publication: Lee, Ansoo; Kim, Hyunwoo
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2015
• Journal volume: 137
• Journal issue: 35
• Pages of publication: 11250 - 11253
• a: 9.0398 ± 0.0005 Å
• b: 9.0398 ± 0.0005 Å
• c: 39.273 ± 0.0019 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 2779.3 ± 0.3 ų
• Cell temperature: 147 ± 2 K
• Ambient diffraction temperature: 147 ± 2 K
• Number of distinct elements: 5
• Space group number: 170
• Hermann-Mauguin space group symbol: P 65
• Hall space group symbol: P 65
• Residual factor for all reflections: 0.0319
• Residual factor for significantly intense reflections: 0.0302
• Weighted residual factors for significantly intense reflections: 0.0709
• Weighted residual factors for all reflections included in the refinement: 0.0716
• Goodness-of-fit parameter for all reflections included in the refinement: 1.07
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No