Information card for entry 4107172

Structure parameters

• Common name: [(iPrNHC)Cu-SiMe2Ph]
• Formula: C41.21 H56.57 Cu N2 Si
• Calculated formula: C41.214 H56.572 Cu N2 Si
• Title of publication: Copper-Mediated Reduction of CO2 with pinB-SiMe2Ph via CO2 Insertion into a Copper-Silicon Bond
• Authors of publication: Christian Kleeberg; Man Sing Cheung; Zhenyang Lin; Todd B. Marder
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2011
• Journal volume: 133
• Pages of publication: 19060 - 19063
• a: 10.2902 ± 0.0002 Å
• b: 20.1875 ± 0.0004 Å
• c: 18.9985 ± 0.0002 Å
• α: 90°
• β: 97.761 ± 0.002°
• γ: 90°
• Cell volume: 3910.47 ± 0.12 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/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0531
• Residual factor for significantly intense reflections: 0.0403
• Weighted residual factors for significantly intense reflections: 0.0862
• Weighted residual factors for all reflections included in the refinement: 0.0913
• Goodness-of-fit parameter for all reflections included in the refinement: 1.068
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No