Information card for entry 4068917

Structure parameters

• Formula: C56 H86 Br2 N2 Ni2 P2
• Calculated formula: C56 H86 Br2 N2 Ni2 P2
• Title of publication: Catalytic Hydrosilylation of the Carbonyl Functionality via a Transient Nickel Hydride Complex
• Authors of publication: Tran, Ba L.; Pink, Maren; Mindiola, Daniel J.
• Journal of publication: Organometallics
• Year of publication: 2009
• Journal volume: 28
• Journal issue: 7
• Pages of publication: 2234
• a: 11.0634 ± 0.0004 Å
• b: 14.6234 ± 0.0005 Å
• c: 18.2598 ± 0.0007 Å
• α: 90°
• β: 94.156 ± 0.001°
• γ: 90°
• Cell volume: 2946.38 ± 0.19 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.056
• Residual factor for significantly intense reflections: 0.0356
• Weighted residual factors for significantly intense reflections: 0.0856
• Weighted residual factors for all reflections included in the refinement: 0.0972
• Goodness-of-fit parameter for all reflections included in the refinement: 1.048
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No