Information card for entry 7247400

Structure parameters

• Formula: C48 H36 O30 Yb4
• Calculated formula: C48 H36 O30 Yb4
• Title of publication: Optimised synthesis and further structural diversity of ytterbium benzene-1,4-dicarboxylate MOFs
• Authors of publication: Chamberlain, Thomas W.; Yasmine,; Coulthard, Claire T.; Clarkson, Guy J.; Degirmenci, Volkan; Krisnandi, Yuni K.; Walton, Richard I.
• Journal of publication: CrystEngComm
• Year of publication: 2023
• Journal volume: 25
• Journal issue: 40
• Pages of publication: 5629 - 5640
• a: 9.59605 ± 0.0001 Å
• b: 26.1011 ± 0.0003 Å
• c: 37.7873 ± 0.0004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 9464.49 ± 0.18 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 4
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.0444
• Residual factor for significantly intense reflections: 0.0344
• Weighted residual factors for significantly intense reflections: 0.0836
• Weighted residual factors for all reflections included in the refinement: 0.086
• Goodness-of-fit parameter for all reflections included in the refinement: 1.076
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No