Information card for entry 7101841

Structure parameters

• Formula: C20 H20 O14 Zn2
• Calculated formula: C20 H12 O14 Zn2
• Title of publication: Ligand flexibility and framework rearrangement in a new family of porous metal-organic frameworks.
• Authors of publication: Hawxwell, Samuel M; Espallargas, Guillermo Mínguez; Bradshaw, Darren; Rosseinsky, Matthew J; Prior, Timothy J; Florence, Alastair J; van de Streek, Jacco; Brammer, Lee
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2007
• Journal issue: 15
• Pages of publication: 1532 - 1534
• a: 9.5471 ± 0.0007 Å
• b: 7.852 ± 0.0007 Å
• c: 8.4756 ± 0.0006 Å
• α: 91.891 ± 0.004°
• β: 107.086 ± 0.003°
• γ: 100.815 ± 0.004°
• Cell volume: 593.9 ± 0.08 ų
• Cell temperature: 298 K
• Ambient diffraction temperature: 298 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor R(I) for significantly intense reflections: 1.585
• Goodness-of-fit parameter for all reflections: 3.853
• Method of determination: powder diffraction
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54056 Å
• Diffraction radiation type: CuKα~1~
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No