Information card for entry 7043061

Structure parameters

• Formula: C40 H51 Li N2 O7 W
• Calculated formula: C40 H51 Li N2 O7 W
• Title of publication: Normal-to-Abnormal Rearrangement of an N-Heterocyclic Carbene with a Silylene Transition Metal Complex
• Authors of publication: Ghadwal, Rajendra S.; Rottschaefer, Dennis; Andrada, Diego Marcelo; Frenking, G.; Schürmann, Christian J.; Stammler, Georg
• Journal of publication: Dalton Trans.
• Year of publication: 2017
• a: 10.86235 ± 0.00011 Å
• b: 18.91698 ± 0.00018 Å
• c: 19.27237 ± 0.00018 Å
• α: 90°
• β: 90.4081 ± 0.0009°
• γ: 90°
• Cell volume: 3960.04 ± 0.07 ų
• Cell temperature: 100 ± 0.1 K
• Ambient diffraction temperature: 100 ± 0.1 K
• Number of distinct elements: 6
• 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: 0.0275
• Residual factor for significantly intense reflections: 0.0212
• Weighted residual factors for significantly intense reflections: 0.0465
• Weighted residual factors for all reflections included in the refinement: 0.0486
• Goodness-of-fit parameter for all reflections included in the refinement: 1.086
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No