Information card for entry 7231779

Structure parameters

• Common name: WUF-19
• Formula: C48 H31 O13.5 Zn4
• Calculated formula: C48 H31 O13.5 Zn4
• Title of publication: High temperature expulsion of thermolabile groups for pore-space expansion in metal‒organic frameworks
• Authors of publication: Bryant, Macguire R.; Ablott, Timothy A.; Telfer, Shane G.; Liu, Lujia; Richardson, Christopher
• Journal of publication: CrystEngComm
• Year of publication: 2019
• Journal volume: 21
• Journal issue: 1
• Pages of publication: 60
• a: 24.47 ± 0.02 Å
• b: 24.029 ± 0.017 Å
• c: 17.149 ± 0.012 Å
• α: 90°
• β: 90.869 ± 0.018°
• γ: 90°
• Cell volume: 10082 ± 13 ų
• Cell temperature: 292 ± 2 K
• Ambient diffraction temperature: 292 K
• Number of distinct elements: 4
• Space group number: 12
• Hermann-Mauguin space group symbol: C 1 2/m 1
• Hall space group symbol: -C 2y
• Residual factor for all reflections: 0.237
• Residual factor for significantly intense reflections: 0.181
• Weighted residual factors for significantly intense reflections: 0.4599
• Weighted residual factors for all reflections included in the refinement: 0.4986
• Goodness-of-fit parameter for all reflections included in the refinement: 2.771
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No