Information card for entry 7712235

Structure parameters

• Formula: C54 H68 B F4 O P4 Rh
• Calculated formula: C54 H68 B F4 O P4 Rh
• SMILES: [Rh]12([P@@](c3ccccc3c3ccccc3)(c3ccccc3)C[P]2(C(C)C)C(C)C)[P@@](c2ccccc2c2ccccc2)(c2ccccc2)C[P]1(C(C)C)C(C)C.[B](F)(F)(F)[F-].O1CCCC1
• Title of publication: Rhodium and ruthenium complexes of methylene-bridged, <i>P</i>-stereogenic, unsymmetrical diphosphanes.
• Authors of publication: Eusamio, Javier; Medina, Yaiza M.; Córdoba, Javier C; Vidal-Ferran, Anton; Sainz, Daniel; Gutiérrez, Albert; Font-Bardia, Mercè; Grabulosa, Arnald
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2023
• Journal volume: 52
• Journal issue: 8
• Pages of publication: 2424 - 2439
• a: 15.6831 ± 0.0015 Å
• b: 14.2537 ± 0.0013 Å
• c: 22.935 ± 0.003 Å
• α: 90°
• β: 96.936 ± 0.005°
• γ: 90°
• Cell volume: 5089.4 ± 0.9 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 7
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.0517
• Residual factor for significantly intense reflections: 0.0365
• Weighted residual factors for significantly intense reflections: 0.0693
• Weighted residual factors for all reflections included in the refinement: 0.0785
• Goodness-of-fit parameter for all reflections included in the refinement: 1.042
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No