Information card for entry 7123416

Structure parameters

• Formula: C51 H67 B F20 Ni P2 Si4
• Calculated formula: C51 H67 B F20 Ni P2 Si4
• Title of publication: A two-coordinate Ni(I) silyl complex: CO2 insertion and oxidatively-induced silyl migrations
• Authors of publication: Witzke, Ryan J.; Tilley, T. Don
• Journal of publication: Chemical Communications
• Year of publication: 2019
• a: 12.588 ± 0.0005 Å
• b: 27.7435 ± 0.0009 Å
• c: 17.8008 ± 0.0006 Å
• α: 90°
• β: 105.41 ± 0.004°
• γ: 90°
• Cell volume: 5993.2 ± 0.4 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 7
• 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: 0.1011
• Residual factor for significantly intense reflections: 0.0562
• Weighted residual factors for significantly intense reflections: 0.1202
• Weighted residual factors for all reflections included in the refinement: 0.1352
• Goodness-of-fit parameter for all reflections included in the refinement: 1.03
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No