Information card for entry 7115171

Structure parameters

• Formula: C17 Cl2 O16 Ru6 Sn
• Calculated formula: C17 Cl2 O16 Ru6 Sn
• SMILES: [C]12345[Ru]6789([Sn](Cl)(Cl)[Ru]%10%1116([Ru]162([Ru]37([Ru]48%101(C#[O])(C#[O])C#[O])([Ru]59%116(C#[O])(C#[O])C#[O])(C#[O])(C#[O])C#[O])(C#[O])(C#[O])C#[O])(C#[O])C#[O])(C#[O])C#[O]
• Title of publication: High yield synthesis and crystal structures of the Ru6‒Sn cluster compounds [Ru6C(CO)16SnCl2] and [Ru6C(CO)16SnCl3]−
• Authors of publication: Hermans, Sophie; Johnson, Brian F. G.
• Journal of publication: Chemical Communications
• Year of publication: 2000
• Journal issue: 19
• Pages of publication: 1955
• a: 16.74 ± 0.006 Å
• b: 16.5 ± 0.007 Å
• c: 20.941 ± 0.009 Å
• α: 90°
• β: 90.96 ± 0.02°
• γ: 90°
• Cell volume: 5783 ± 4 ų
• Cell temperature: 180 ± 2 K
• Ambient diffraction temperature: 180 ± 2 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0413
• Residual factor for significantly intense reflections: 0.033
• Weighted residual factors for all reflections: 0.0624
• Weighted residual factors for significantly intense reflections: 0.0601
• Goodness-of-fit parameter for all reflections: 1.036
• Goodness-of-fit parameter for significantly intense reflections: 1.099
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No