Information card for entry 7712234

Structure parameters

• Formula: C35 H44 Cl F6 P3 Ru
• Calculated formula: C35 H44 Cl F6 P3 Ru
• SMILES: [Ru]123456(Cl)([P](C[P@@]1(c1ccccc1)c1ccccc1c1ccccc1)(C(C)C)C(C)C)[c]1([cH]6[cH]5[c]4([cH]3[cH]21)C)C(C)C.[P](F)(F)(F)(F)(F)[F-]
• 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: 10.6343 ± 0.0008 Å
• b: 15.3026 ± 0.0011 Å
• c: 10.7939 ± 0.0008 Å
• α: 90°
• β: 92.589 ± 0.003°
• γ: 90°
• Cell volume: 1754.7 ± 0.2 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.0194
• Residual factor for significantly intense reflections: 0.0187
• Weighted residual factors for significantly intense reflections: 0.0433
• Weighted residual factors for all reflections included in the refinement: 0.044
• Goodness-of-fit parameter for all reflections included in the refinement: 1.037
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No