Information card for entry 4065864

Structure parameters

• Formula: C32 H32 B F2 O2 P2 Rh
• Calculated formula: C32 H32 B F2 O2 P2 Rh
• SMILES: [B]1(F)(F)O[P](c2ccccc2)(c2ccccc2)[Rh]234([CH]5CC[CH]2=[CH]3CC[CH]4=5)[P](c2ccccc2)(c2ccccc2)O1
• 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: 12.546 ± 0.003 Å
• b: 17.317 ± 0.004 Å
• c: 13.706 ± 0.003 Å
• α: 90°
• β: 100.84 ± 0.03°
• γ: 90°
• Cell volume: 2924.6 ± 1.2 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 2 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0416
• Residual factor for significantly intense reflections: 0.0265
• Weighted residual factors for significantly intense reflections: 0.051
• Weighted residual factors for all reflections included in the refinement: 0.0532
• Goodness-of-fit parameter for all reflections included in the refinement: 0.894
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No