Information card for entry 7049389

Structure parameters

• Formula: C80 H73 F10 N8 O3 Zn3
• Calculated formula: C80 H73 F10 N8 O3 Zn3
• Title of publication: Polynuclear alkoxy-zinc complexes of bowl-shaped macrocycles and their use in the copolymerisation of cyclohexene oxide and CO₂.
• Authors of publication: Pankhurst, James R.; Paul, Shyeni; Zhu, Yunqing; Williams, Charlotte K.; Love, Jason B.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2019
• Journal volume: 48
• Journal issue: 15
• Pages of publication: 4887 - 4893
• a: 13.6817 ± 0.0003 Å
• b: 17.1958 ± 0.0004 Å
• c: 17.9104 ± 0.0004 Å
• α: 105.877 ± 0.002°
• β: 105.185 ± 0.002°
• γ: 104.788 ± 0.002°
• Cell volume: 3660.91 ± 0.17 ų
• Cell temperature: 170 K
• Ambient diffraction temperature: 170 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: 0.0579
• Residual factor for significantly intense reflections: 0.0401
• Weighted residual factors for significantly intense reflections: 0.0816
• Weighted residual factors for all reflections included in the refinement: 0.088
• Goodness-of-fit parameter for all reflections included in the refinement: 1.044
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No