Information card for entry 2011588

Structure parameters

• Formula: C9 H20 B10 Co2 O5 S2
• Calculated formula: C9 H20 B10 Co2 O5 S2
• SMILES: C(#[O])[Co]12345(C#[O])C(=O)[Co]6781(C#[O])(C#[O])[BH]192[B]2%103([S](C)C)[BH]3%114[BH]456[BH]56%11[BH]%11%103[BH]392[BH]271[B]845([S](C)C)[BH]6%1132
• Title of publication: [1,1,2,2-(CO)~4~-1,2-μ-(CO)-4,11-(SMe~2~)~2~-<i>closo</i>-1,2-Co~2~B~10~H~8~]
• Authors of publication: Londesborough, Michael G.S.; Bould, Jonathan; Holub, Josef; Kennedy, John D.; Thornton-Pett, Mark; Štíbr, Bohumil
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2000
• Journal volume: 56
• Journal issue: 12
• Pages of publication: 1423 - 1424
• a: 12.2978 ± 0.0002 Å
• b: 10.9183 ± 0.0002 Å
• c: 30.59 ± 0.0005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 4107.35 ± 0.12 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 6
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.0517
• Residual factor for significantly intense reflections: 0.0316
• Weighted residual factors for all reflections included in the refinement: 0.0613
• Goodness-of-fit parameter for all reflections included in the refinement: 1.026
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No