Information card for entry 7711208

Structure parameters

• Formula: C27 H38 B Cl N6 Zn
• Calculated formula: C27 H38 B Cl N6 Zn
• Title of publication: Synthesis and reactivity of a tris(carbene) zinc chloride complex
• Authors of publication: Sherbow, Tobias J.; Li, Keyan; Zakharov, Lev N.; Pluth, Michael D.
• Journal of publication: Dalton Transactions
• Year of publication: 2022
• a: 9.6756 ± 0.0003 Å
• b: 17.8862 ± 0.0005 Å
• c: 16.4972 ± 0.0005 Å
• α: 90°
• β: 92.369 ± 0.002°
• γ: 90°
• Cell volume: 2852.56 ± 0.15 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 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: 0.0429
• Residual factor for significantly intense reflections: 0.0362
• Weighted residual factors for significantly intense reflections: 0.1006
• Weighted residual factors for all reflections included in the refinement: 0.1059
• Goodness-of-fit parameter for all reflections included in the refinement: 0.908
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No