Information card for entry 4085519

Structure parameters

• Formula: C66 H36 F9.98 N8 O5 Zn4
• Calculated formula: C66 H36 F9.98 N8 O5 Zn4
• Title of publication: Macrocyclic Platforms for the Construction of Tetranuclear Oxo and Hydroxo Zinc Clusters
• Authors of publication: Cadenbach, Thomas; Pankhurst, James R.; Hofmann, Tommy A.; Curcio, Massimiliano; Arnold, Polly L.; Love, Jason B.
• Journal of publication: Organometallics
• Year of publication: 2015
• Journal volume: 34
• Journal issue: 11
• Pages of publication: 2608
• a: 12.5794 ± 0.0003 Å
• b: 14.5209 ± 0.0008 Å
• c: 21.8649 ± 0.001 Å
• α: 104.772 ± 0.004°
• β: 99.895 ± 0.003°
• γ: 102.885 ± 0.004°
• Cell volume: 3652.2 ± 0.3 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173.15 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: 0.1379
• Residual factor for significantly intense reflections: 0.0992
• Weighted residual factors for significantly intense reflections: 0.2673
• Weighted residual factors for all reflections included in the refinement: 0.3069
• Goodness-of-fit parameter for all reflections included in the refinement: 1.054
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No