Information card for entry 7123415

Structure parameters

• Common name: RJW_3_184
• Chemical name: IPrNiC(SiMe3)3
• Formula: C37 H63 N2 Ni Si3
• Calculated formula: C37 H63 N2 Ni Si3
• 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: 10.9273 ± 0.0006 Å
• b: 18.0527 ± 0.0011 Å
• c: 20.2837 ± 0.0013 Å
• α: 90°
• β: 98.521 ± 0.003°
• γ: 90°
• Cell volume: 3957.1 ± 0.4 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0731
• Residual factor for significantly intense reflections: 0.0532
• Weighted residual factors for significantly intense reflections: 0.1264
• Weighted residual factors for all reflections included in the refinement: 0.1368
• Goodness-of-fit parameter for all reflections included in the refinement: 1.072
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No