Information card for entry 7105531

Structure parameters

• Formula: C184 H121 F30 N37 O30 S20 Zn5
• Calculated formula: C170 H100 F30 N30 O30 S20 Zn5
• Title of publication: Controlling the formation of metallosupramolecular assemblies by metal ionic radii
• Authors of publication: Bain, Lindsay; Bullock, Sam; Harding, Lindsay; Riis-Johannessen, T.; Midgley, Gary; Rice, Craig R.; Whitehead, Martina
• Journal of publication: Chemical Communications
• Year of publication: 2010
• Journal volume: 46
• Journal issue: 20
• Pages of publication: 3496
• a: 22.5172 ± 0.0019 Å
• b: 24.756 ± 0.002 Å
• c: 36 ± 0.003 Å
• α: 90°
• β: 96.827 ± 0.002°
• γ: 90°
• Cell volume: 19925 ± 3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 7
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.1413
• Residual factor for significantly intense reflections: 0.1236
• Weighted residual factors for significantly intense reflections: 0.3224
• Weighted residual factors for all reflections included in the refinement: 0.3312
• Goodness-of-fit parameter for all reflections included in the refinement: 1.149
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No