Information card for entry 4038831

Structure parameters

• Formula: C20 H27 N O2 P2
• Calculated formula: C20 H27 N O2 P2
• 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: 9.856 ± 0.0002 Å
• b: 11.5291 ± 0.0002 Å
• c: 17.2583 ± 0.0004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1961.07 ± 0.07 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 5
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0306
• Residual factor for significantly intense reflections: 0.0286
• Weighted residual factors for significantly intense reflections: 0.0738
• Weighted residual factors for all reflections included in the refinement: 0.0755
• Goodness-of-fit parameter for all reflections included in the refinement: 1.033
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No