Information card for entry 4109214

Structure parameters

• Formula: C38 H43 B9 Os P2
• Calculated formula: C38 H43 B9 Os P2
• SMILES: [OsH2]123([P](c4ccccc4)(c4ccccc4)c4ccccc4)([P](c4ccccc4)(c4ccccc4)c4ccccc4)[B]456([BH]789[BH]%10%11%12[BH]%13%14%15[BH]%16%17%10[BH]%107%11[BH]%17([CH]%14%16[B]26%15([BH]48%12%13)[H]3)[CH]59%10)[H]1
• Title of publication: Stable exo-nido-Metallacarboranes (M = OsIV) that Incorporatemeta-Carborane-Based Dicarbollide Ligands
• Authors of publication: Elena V. Balagurova; Dmitri N. Cheredilin; Galina D. Kolomnikova; Oleg L. Tok; Fedor M. Dolgushin; Alexander I. Yanovsky; Igor T. Chizhevsky
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2007
• Journal volume: 129
• Pages of publication: 3745 - 3753
• a: 12.819 ± 0.003 Å
• b: 12.963 ± 0.003 Å
• c: 13.787 ± 0.003 Å
• α: 75.405 ± 0.016°
• β: 62.997 ± 0.015°
• γ: 69.875 ± 0.016°
• Cell volume: 1904 ± 0.8 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.116
• Residual factor for significantly intense reflections: 0.0589
• Weighted residual factors for significantly intense reflections: 0.0795
• Weighted residual factors for all reflections included in the refinement: 0.0865
• Goodness-of-fit parameter for all reflections included in the refinement: 1.065
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No