Information card for entry 4038832

Structure parameters

• Formula: C40 H54 B F4 N2 O4 P4 Rh
• Calculated formula: C40 H54 B F4 N2 O4 P4 Rh
• Title of publication: P-chirogenic Diphosphazanes with Axially Chiral Substituents and their Use in Rh-catalyzed Asymmetric Hydrogenation.
• Authors of publication: Moritz, Jan-Ole; Chakrabortty, Soumyadeep; Müller, Bernd H; Spannenberg, Anke; Kamer, Paul C. J.
• Journal of publication: The Journal of organic chemistry
• Year of publication: 2020
• a: 10.8041 ± 0.0006 Å
• b: 15.3336 ± 0.0008 Å
• c: 13.3346 ± 0.0007 Å
• α: 90°
• β: 102.262 ± 0.0014°
• γ: 90°
• Cell volume: 2158.7 ± 0.2 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 8
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.0254
• Residual factor for significantly intense reflections: 0.0254
• Weighted residual factors for significantly intense reflections: 0.0682
• Weighted residual factors for all reflections included in the refinement: 0.0682
• Goodness-of-fit parameter for all reflections included in the refinement: 1.044
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No