Information card for entry 7126763

Structure parameters

• Formula: C25 H39 N O Zn2
• Calculated formula: C25 H39 N O Zn2
• Title of publication: Intermediate snapshot on the insertion reaction of isocyanates into the Zn-Cp* bond of dizincocene Cp*₂Zn₂.
• Authors of publication: Li, Bin; Wölper, Christoph; Huse, Kevin; Schulz, Stephan
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2020
• Journal volume: 56
• Journal issue: 61
• Pages of publication: 8643 - 8646
• a: 9.0241 ± 0.001 Å
• b: 12.0224 ± 0.0013 Å
• c: 12.0743 ± 0.0013 Å
• α: 90°
• β: 110.467 ± 0.005°
• γ: 90°
• Cell volume: 1227.3 ± 0.2 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 11
• Hermann-Mauguin space group symbol: P 1 21/m 1
• Hall space group symbol: -P 2yb
• Residual factor for all reflections: 0.0374
• Residual factor for significantly intense reflections: 0.0241
• Weighted residual factors for significantly intense reflections: 0.0611
• Weighted residual factors for all reflections included in the refinement: 0.0695
• Goodness-of-fit parameter for all reflections included in the refinement: 1.082
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No