Information card for entry 4325366

Structure parameters

• Formula: C48 H60 B2 Cl2 F8 P2 Rh2 n4
• Calculated formula: C48 H60 B2 Cl2 F8 N4 P2 Rh2
• SMILES: [Rh]123([P](C[P]([Rh]456[CH]7=[CH]4C4[CH]5=[CH]6C7C4)(c4c(N(C)C)cccc4)c4c(N(C)C)cccc4)(c4c(N(C)C)cccc4)c4c(N(C)C)cccc4)[CH]4=[CH]1C1[CH]2=[CH]3C4C1.[B](F)(F)(F)[F-].[B](F)(F)(F)[F-].ClCCl
• Title of publication: Comparison of Structure and Reactivity of Phosphine-Amido and Hemilabile Phosphine-Amine Chelates of Rhodium
• Authors of publication: Lindsay J. Hounjet; Robert McDonald; Michael J. Ferguson; Martin Cowie
• Journal of publication: Inorganic Chemistry
• Year of publication: 2011
• Journal volume: 50
• Pages of publication: 5361 - 5378
• a: 14.4151 ± 0.0005 Å
• b: 15.3563 ± 0.0005 Å
• c: 22.503 ± 0.0008 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 4981.3 ± 0.3 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 8
• 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: 0.0262
• Residual factor for significantly intense reflections: 0.0249
• Weighted residual factors for significantly intense reflections: 0.0625
• Weighted residual factors for all reflections included in the refinement: 0.0632
• Goodness-of-fit parameter for all reflections included in the refinement: 1.045
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No