Information card for entry 4513948

Structure parameters

• Common name: Zhiyao042215
• Formula: C25 H38 B3 Cl2 I N12 Ni2
• Calculated formula: C25 H38 B3 Cl2 I N12 Ni2
• Title of publication: Di(carbene)-Supported Nickel Systems for CO2Reduction Under Ambient Conditions
• Authors of publication: Lu, Zhiyao; Williams, Travis J.
• Journal of publication: ACS Catalysis
• Year of publication: 2016
• Journal volume: 6
• Journal issue: 10
• Pages of publication: 6670
• a: 12.3061 ± 0.001 Å
• b: 12.6455 ± 0.001 Å
• c: 13.1675 ± 0.001 Å
• α: 78.8847 ± 0.0012°
• β: 71.0045 ± 0.0012°
• γ: 87.4156 ± 0.0012°
• Cell volume: 1900.8 ± 0.3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0328
• Residual factor for significantly intense reflections: 0.0244
• Weighted residual factors for significantly intense reflections: 0.0555
• Weighted residual factors for all reflections included in the refinement: 0.0584
• Goodness-of-fit parameter for all reflections included in the refinement: 1.032
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No