Information card for entry 4004046

Structure parameters

• Formula: C41 H18 N2 O11 Zn2
• Calculated formula: C40.5 H18 N2 O11 Zn2
• Title of publication: Integration of Fluorescent Functionality into Pressure-Amplifying Metal–Organic Frameworks
• Authors of publication: Walenszus, Francesco; Evans, Jack D.; Bon, Volodymyr; Schwotzer, Friedrich; Senkovska, Irena; Kaskel, Stefan
• Journal of publication: Chemistry of Materials
• Year of publication: 2021
• Journal volume: 33
• Journal issue: 20
• Pages of publication: 7964 - 7971
• a: 46.47 ± 0.005 Å
• b: 46.47 ± 0.005 Å
• c: 46.47 ± 0.005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 100350 ± 19 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.0922
• Residual factor for significantly intense reflections: 0.0787
• Weighted residual factors for significantly intense reflections: 0.2415
• Weighted residual factors for all reflections included in the refinement: 0.2698
• Goodness-of-fit parameter for all reflections included in the refinement: 1.139
• Diffraction radiation wavelength: 0.895 Å
• Diffraction radiation type: synchrotron
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No