Information card for entry 4073276

Structure parameters

• Formula: C32 H58 Cl6 F6 O6 P4 Ru2 S2
• Calculated formula: C32 H58 Cl6 F6 O6 P4 Ru2 S2
• SMILES: [Ru]123456(Cl)([Cl][Ru]789%10([P]([P]1(C)C)(C)C)([P]([P]2(C)C)(C)C)[c]1([c]7([c]8([c]9([c]%101C)C)C)C)C)[c]1([c]6([c]5([c]4([c]31C)C)C)C)C.ClCCl.ClCCl.S(=O)(=O)([O-])C(F)(F)F.S(=O)(=O)([O-])C(F)(F)F
• Title of publication: Synthesis and Reactivity of Diphosphine-Bridged Diruthenium Complexes
• Authors of publication: Miyake, Yoshihiro; Nomaguchi, Yohei; Yuki, Masahiro; Nishibayashi, Yoshiaki
• Journal of publication: Organometallics
• Year of publication: 2007
• Journal volume: 26
• Journal issue: 14
• Pages of publication: 3611
• a: 11.9463 ± 0.0002 Å
• b: 13.3142 ± 0.0001 Å
• c: 17.366 ± 0.0005 Å
• α: 72.97 ± 0.002°
• β: 78.2095 ± 0.0018°
• γ: 67.3295 ± 0.0012°
• Cell volume: 2423.86 ± 0.09 ų
• Cell temperature: 173.1 K
• Number of distinct elements: 8
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for significantly intense reflections: 0.0472
• Weighted residual factors for all reflections included in the refinement: 0.1157
• Goodness-of-fit parameter for all reflections included in the refinement: 1.036
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No