Information card for entry 2218157

Structure parameters

• Chemical name: Decacarbonyl-1κ^3^C,2κ^3^C,3κ^4^C-μ-hydrido-1:2κ^2^H:H-(μ- quinoline-2-thiolato-1:2κ^2^S:S)diosmium(I)osmium(0)(3 Os—Os)
• Formula: C19 H7 N O10 Os3 S
• Calculated formula: C19 H7 N O10 Os3 S
• SMILES: [Os]123([Os]([Os]1(C#[O])(C#[O])(C#[O])C#[O])([S]2c1nc2ccccc2cc1)([H]3)(C#[O])(C#[O])C#[O])(C#[O])(C#[O])C#[O]
• Title of publication: Decacarbonyl-1κ^3^<i>C</i>,2κ^3^<i>C</i>,3κ^4^<i>C</i>-μ-hydrido-1:2κ^2^<i>H</i>:<i>H</i>-(μ-quinoline-2-thiolato-1:2κ^2^<i>S</i>:<i>S</i>)diosmium(I)osmium(0)(3 <i>Os</i>—<i>Os</i>)
• Authors of publication: Sun, Yu; Li, Xiu-Bing; Sun, Bai-Wang
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2008
• Journal volume: 64
• Journal issue: 5
• Pages of publication: m608
• a: 9.3593 ± 0.0005 Å
• b: 9.4129 ± 0.0005 Å
• c: 25.7433 ± 0.0014 Å
• α: 90°
• β: 93.045 ± 0.001°
• γ: 90°
• Cell volume: 2264.7 ± 0.2 ų
• Cell temperature: 223 ± 2 K
• Ambient diffraction temperature: 223 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0269
• Residual factor for significantly intense reflections: 0.0238
• Weighted residual factors for significantly intense reflections: 0.051
• Weighted residual factors for all reflections included in the refinement: 0.0519
• Goodness-of-fit parameter for all reflections included in the refinement: 1.136
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes