Information card for entry 4002122

Structure parameters

• Formula: C8 Al F O4
• Calculated formula: C8 Al F O4
• Title of publication: Contradistinct Thermoresponsive Behavior of Isostructural MIL-53 Type Metal‒Organic Frameworks by Modifying the Framework Inorganic Anion
• Authors of publication: Nanthamathee, Chompoonoot; Ling, Sanliang; Slater, Ben; Attfield, Martin P.
• Journal of publication: Chemistry of Materials
• Year of publication: 2014
• Pages of publication: 141223143002002
• a: 6.55388 ± 0.00012 Å
• b: 16.439 ± 0.0004 Å
• c: 13.1379 ± 0.0004 Å
• α: 90°
• β: 90°
• γ: 90.5441 ± 0.0014°
• Cell volume: 1415.4 ± 0.06 ų
• Number of distinct elements: 4
• Space group number: 15
• Hermann-Mauguin space group symbol: I 1 1 2/b
• Hall space group symbol: -I 2b
• RFsqd: 0.24821
• Goodness-of-fit parameter for all reflections: 2.53
• Method of determination: powder diffraction
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.827154 Å
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No