Information card for entry 4065866

Structure parameters

• Formula: C50 H47 O4 P4 Rh
• Calculated formula: C50 H47 O4 P4 Rh
• SMILES: c1(ccccc1)[P](c1ccccc1)(OC)[Rh]([P](c1ccccc1)(c1ccccc1)OC)([P](c2ccccc2)(c2ccccc2)O)[P](c1ccccc1)(c1ccccc1)[O-]
• Title of publication: Reaction of Secondary Phosphine Oxides with Rhodium(I)
• Authors of publication: Christiansen, Andrea; Selent, Detlef; Spannenberg, Anke; Baumann, Wolfgang; Franke, Robert; Börner, Armin
• Journal of publication: Organometallics
• Year of publication: 2010
• Journal volume: 29
• Journal issue: 14
• Pages of publication: 3139
• a: 10.924 ± 0.002 Å
• b: 11.766 ± 0.002 Å
• c: 19.58 ± 0.004 Å
• α: 106.88 ± 0.03°
• β: 91.35 ± 0.03°
• γ: 111.89 ± 0.03°
• Cell volume: 2209.8 ± 1 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0436
• Residual factor for significantly intense reflections: 0.0272
• Weighted residual factors for significantly intense reflections: 0.0522
• Weighted residual factors for all reflections included in the refinement: 0.0551
• Goodness-of-fit parameter for all reflections included in the refinement: 0.886
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No