Information card for entry 4342810

Structure parameters

• Formula: C10 H24 B10 Os
• Calculated formula: C10 H24 B10 Os
• SMILES: [Os]123456789%10([c]%11([cH]5[cH]4[c]3([cH]2[cH]1%11)C(C)C)C)[BH]12[BH]347[BH]578[BH]86[BH]6%119[BH]9%101[BH]123[BH]247[BH]586[BH]%11912
• Title of publication: Redox Levels of a closo-Osmaborane: A Density Functional Theory, Electron Paramagnetic Resonance and Electrochemical Study.
• Authors of publication: Simonov, Alexandr N.; Boas, John F.; Skidmore, Melissa A.; Forsyth, Craig M.; Mashkina, Elena; Bown, Mark; Bond, Alan M.
• Journal of publication: Inorganic chemistry
• Year of publication: 2015
• Journal volume: 54
• Journal issue: 9
• Pages of publication: 4292 - 4302
• a: 7.7693 ± 0.0003 Å
• b: 14.0374 ± 0.0005 Å
• c: 29.9826 ± 0.0012 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3269.9 ± 0.2 ų
• Cell temperature: 123 ± 2 K
• Ambient diffraction temperature: 123 ± 2 K
• Number of distinct elements: 4
• 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: 0.0247
• Residual factor for significantly intense reflections: 0.0216
• Weighted residual factors for significantly intense reflections: 0.0483
• Weighted residual factors for all reflections included in the refinement: 0.0499
• Goodness-of-fit parameter for all reflections included in the refinement: 1.1
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No