Information card for entry 1563957

Structure parameters

• Chemical name: MOF-711
• Formula: C16 H8 O16 Zr3
• Calculated formula: C16 H8 O15.941 Zr3
• Title of publication: 'Eye' of the molecule-a viewpoint.
• Authors of publication: Lee, Seungkyu; Yaghi, Omar M.
• Journal of publication: Faraday discussions
• Year of publication: 2021
• Journal volume: 231
• Journal issue: 0
• Pages of publication: 145 - 149
• a: 13.4687 ± 0.0015 Å
• b: 14.8959 ± 0.0017 Å
• c: 21.264 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 4266.2 ± 0.8 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 4
• Space group number: 58
• Hermann-Mauguin space group symbol: P n n m
• Hall space group symbol: -P 2 2n
• Residual factor for all reflections: 0.0522
• Residual factor for significantly intense reflections: 0.041
• Weighted residual factors for significantly intense reflections: 0.1068
• Weighted residual factors for all reflections included in the refinement: 0.1111
• Goodness-of-fit parameter for all reflections included in the refinement: 0.999
• Diffraction radiation wavelength: 0.7749 Å
• Diffraction radiation type: synchrotron
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No