Information card for entry 4083811

Structure parameters

• Formula: C50 H50 F6 P3 Rh
• Calculated formula: C50 H50 F6 P3 Rh
• SMILES: [Rh]1234([P@@]56C[C@@](C(=C5c5ccccc5)C)(C(=C6C=CC5=C([C@]6(C[P@@]15C(=C6C)c1ccccc1)C)c1ccccc1)c1ccccc1)C)[CH]1=[CH]2CC[CH]3=[CH]4CC1.[P](F)(F)(F)(F)(F)[F-]
• Title of publication: C2-BIPNOR: An Easily Accessible Homologue of BIPNOR for Asymmetric Catalysis
• Authors of publication: Siutkowski, Magali; Mercier, François; Ricard, Louis; Mathey, François
• Journal of publication: Organometallics
• Year of publication: 2006
• Journal volume: 25
• Journal issue: 10
• Pages of publication: 2585
• a: 12.737 ± 0.005 Å
• b: 16.766 ± 0.005 Å
• c: 20.593 ± 0.005 Å
• α: 90 ± 0.005°
• β: 90 ± 0.005°
• γ: 90 ± 0.005°
• Cell volume: 4398 ± 2 ų
• Cell temperature: 150 ± 1 K
• Ambient diffraction temperature: 150 ± 1 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: 0.0558
• Residual factor for significantly intense reflections: 0.049
• Weighted residual factors for significantly intense reflections: 0.1243
• Weighted residual factors for all reflections included in the refinement: 0.1293
• Goodness-of-fit parameter for all reflections included in the refinement: 1.004
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No