Information card for entry 4107169

Structure parameters

• Common name: [(iPrNHC)Cu-CO2-SiMe2Ph]
• Formula: C39 H54 Cu N2 O2 Si
• Calculated formula: C39 H54 Cu N2 O2 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: 13.5028 ± 0.0004 Å
• b: 17.0624 ± 0.0005 Å
• c: 18.3259 ± 0.0006 Å
• α: 71.894 ± 0.001°
• β: 81.313 ± 0.001°
• γ: 73.53 ± 0.001°
• Cell volume: 3839.2 ± 0.2 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0853
• Residual factor for significantly intense reflections: 0.059
• Weighted residual factors for significantly intense reflections: 0.1534
• Weighted residual factors for all reflections included in the refinement: 0.1727
• Goodness-of-fit parameter for all reflections included in the refinement: 1.075
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No