Information card for entry 4336466

Structure parameters

• Formula: C11 H30 F12 O6 P2 Ru S5
• Calculated formula: C11 H30 F12 O6 P2 Ru S5
• SMILES: [Ru]([S](=O)(C)C)([S](=O)(C)C)([O]=S(C)C)([O]=S(C)C)([O]=S(C)C)C#[O].[P](F)(F)(F)(F)(F)[F-].[P](F)(F)(F)(F)(F)[F-]
• Title of publication: New Cationic and Neutral Ru(II)- and Os(II)-dmso carbonyl Compounds
• Authors of publication: Ioannis Bratsos; Simone Calmo; Ennio Zangrando; Gabriele Balducci; Enzo Alessio
• Journal of publication: Inorganic Chemistry
• Year of publication: 2013
• Journal volume: 52
• Pages of publication: 12120 - 12130
• a: 14.475 ± 0.0012 Å
• b: 10.364 ± 0.0011 Å
• c: 21.043 ± 0.003 Å
• α: 90°
• β: 108.137 ± 0.01°
• γ: 90°
• Cell volume: 3000 ± 0.6 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.1038
• Residual factor for significantly intense reflections: 0.0552
• Weighted residual factors for significantly intense reflections: 0.1659
• Weighted residual factors for all reflections included in the refinement: 0.1837
• Goodness-of-fit parameter for all reflections included in the refinement: 1.013
• Diffraction radiation wavelength: 1.5418 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No