Information card for entry 7108519

Structure parameters

• Formula: C40 H20 N2 O10 Zn2
• Calculated formula: C40 H20 N2 O10 Zn2
• Title of publication: A highly porous metal organic framework, constructed from a cuboctahedral super-molecular building block, with exceptionally high methane uptake
• Authors of publication: Ulrich Stoeck; Simon Krause; Volodymyr Bon; Irena Senkovska; Stefan Kaskel
• Journal of publication: Chem.Commun.
• Year of publication: 2012
• Journal volume: 48
• Pages of publication: 10841
• a: 46.806 ± 0.005 Å
• b: 46.806 ± 0.005 Å
• c: 46.806 ± 0.005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 102543 ± 19 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 5
• Space group number: 225
• Hermann-Mauguin space group symbol: F m -3 m
• Hall space group symbol: -F 4 2 3
• Residual factor for all reflections: 0.0782
• Residual factor for significantly intense reflections: 0.0548
• Weighted residual factors for significantly intense reflections: 0.1822
• Weighted residual factors for all reflections included in the refinement: 0.1968
• Goodness-of-fit parameter for all reflections included in the refinement: 0.884
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.88561 Å
• Diffraction radiation type: synchrotron
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No