Information card for entry 7702890

Structure parameters

• Common name: Rubim_Cl
• Chemical name: Rubim_Cl
• Formula: C21 H17 Cl F6 N7 P Ru
• Calculated formula: C21 H17 Cl F6 N7 P Ru
• Title of publication: A mononuclear ruthenium complex showing multiple proton-coupled electron transfer toward multi-electron transfer reactions.
• Authors of publication: Okamura, Masaya; Yoshida, Masaki; Kuga, Reiko; Sakai, Ken; Kondo, Mio; Masaoka, Shigeyuki
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2012
• Journal volume: 41
• Journal issue: 42
• Pages of publication: 13081 - 13089
• a: 8.6074 ± 0.0019 Å
• b: 8.6074 ± 0.0019 Å
• c: 32.612 ± 0.007 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2416.1 ± 0.9 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 7
• Space group number: 76
• Hermann-Mauguin space group symbol: P 41
• Hall space group symbol: P 4w
• Residual factor for all reflections: 0.0367
• Residual factor for significantly intense reflections: 0.0325
• Weighted residual factors for significantly intense reflections: 0.0654
• Weighted residual factors for all reflections included in the refinement: 0.067
• Goodness-of-fit parameter for all reflections included in the refinement: 1.099
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No