Information card for entry 7700042

Structure parameters

• Formula: C8 H2 O7 Zn2
• Calculated formula: C8 H2 O7 Zn2
• Title of publication: Tuning the supramolecular isomerism of MOF-74 by controlling the synthesis conditions
• Authors of publication: Gheorghe, Andreea; Imaz, Inhar; van der Vlugt, Jarl Ivar; Maspoch, Daniel; Tanase, Stefania
• Journal of publication: Dalton Transactions
• Year of publication: 2019
• a: 22.97 ± 0.005 Å
• b: 22.97 ± 0.005 Å
• c: 15.91 ± 0.005 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 7270 ± 3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 4
• Space group number: 167
• Hermann-Mauguin space group symbol: R -3 c :H
• Hall space group symbol: -R 3 2"c
• Residual factor for all reflections: 0.0586
• Residual factor for significantly intense reflections: 0.056
• Weighted residual factors for significantly intense reflections: 0.1726
• Weighted residual factors for all reflections included in the refinement: 0.1746
• Goodness-of-fit parameter for all reflections included in the refinement: 1.194
• Diffraction radiation wavelength: 0.72656 Å
• Diffraction radiation type: synchrotron
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No