Information card for entry 4120954

Structure parameters

• Common name: tBuP2BHCoBH4
• Formula: C24 H49 B2 Co N2 P2
• Calculated formula: C24 H49 B2 Co N2 P2
• Title of publication: Boryl-Mediated Reversible H2 Activation at Cobalt: Catalytic Hydrogenation, Dehydrogenation, and Transfer Hydrogenation
• Authors of publication: Tzu-Pin Lin; Jonas C. Peters
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2013
• Journal volume: 135
• Pages of publication: 15310 - 15313
• a: 11.8394 ± 0.0012 Å
• b: 14.3974 ± 0.0016 Å
• c: 32.035 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 5460.6 ± 1 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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: 0.071
• Residual factor for significantly intense reflections: 0.0442
• Weighted residual factors for significantly intense reflections: 0.1332
• Weighted residual factors for all reflections included in the refinement: 0.15
• Goodness-of-fit parameter for all reflections included in the refinement: 1.013
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No