Information card for entry 4000274

Structure parameters

• Formula: C12 H16 F12 N2 O6 Ru
• Calculated formula: C12 H16 F12 N2 O6 Ru
• SMILES: [O]#C[Ru]12(C#[O])([NH2]CC(O2)(C(F)(F)F)C(F)(F)F)[NH2]CC(O1)(C(F)(F)F)C(F)(F)F.OC.OC
• Journal of publication: Chemistry of Materials
• Year of publication: 2003
• a: 17.4585 ± 0.0003 Å
• b: 9.9702 ± 0.0001 Å
• c: 12.2534 ± 0.0002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2132.88 ± 0.05 ų
• Cell temperature: 150 ± 1 K
• Ambient diffraction temperature: 150 ± 1 K
• Number of distinct elements: 6
• Space group number: 60
• Hermann-Mauguin space group symbol: P b c n
• Hall space group symbol: -P 2n 2ab
• Residual factor for all reflections: 0.0655
• Residual factor for significantly intense reflections: 0.0354
• Weighted residual factors for significantly intense reflections: 0.0817
• Weighted residual factors for all reflections included in the refinement: 0.108
• Goodness-of-fit parameter for all reflections included in the refinement: 1.153
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No