Information card for entry 4337129

Structure parameters

• Formula: C20 H38 B6 Co2
• Calculated formula: C20 H38 B6 Co2
• SMILES: [BH]123[BH]456[BH]1([Co]1789%106([BH]6%114[BH]41[BH]6([Co]16%12%1325%11[c]2([c]%13([c]%12([c]6([c]12C)C)C)C)C)[H]4)[c]1([c]7([c]8([c]9([c]%101C)C)C)C)C)[H]3
• Title of publication: A Novel Heterometallic μ9-Boride Cluster: Synthesis and Structural Characterization of [(η(5)-C5Me5Rh)2{Co6(CO)12}(μ-H)(BH)B].
• Authors of publication: Roy, Dipak Kumar; Barik, Subrat Kumar; Mondal, Bijan; Varghese, Babu; Ghosh, Sundargopal
• Journal of publication: Inorganic chemistry
• Year of publication: 2014
• Journal volume: 53
• Journal issue: 2
• Pages of publication: 667 - 669
• a: 8.2502 ± 0.0005 Å
• b: 10.8875 ± 0.0007 Å
• c: 14.7638 ± 0.001 Å
• α: 70.007 ± 0.002°
• β: 77.884 ± 0.002°
• γ: 73.479 ± 0.002°
• Cell volume: 1185.39 ± 0.13 ų
• Cell temperature: 273 ± 2 K
• Ambient diffraction temperature: 273 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.047
• Residual factor for significantly intense reflections: 0.0319
• Weighted residual factors for significantly intense reflections: 0.0812
• Weighted residual factors for all reflections included in the refinement: 0.093
• Goodness-of-fit parameter for all reflections included in the refinement: 1.068
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No