Information card for entry 7120280

Structure parameters

• Common name: MIL-173
• Chemical name: Zr2(PorphGal)
• Formula: C54 H62.4 N9 O16.7 Zr2
• Calculated formula: C54.0004 H16 N9 O16.698 Zr2
• Title of publication: Adaptability of the metal(III,IV) 1,2,3-trioxobenzene rod Second-ary Building Unit for the production of chemically stable and catalyt-ically active Metal-Organic Frameworks
• Authors of publication: Mouchaham, Georges; Abeykoon, Brain; Giménez-Marqués, Mónica; Navalon, Sergio; Santiago-Portillo, Andrea; affram, maame; Guillou, Nathalie; Martineau, Charlotte; Garcia, Hermenegildo; Fateeva, Alexandra; Devic, Thomas
• Journal of publication: Chem. Commun.
• Year of publication: 2017
• a: 28.4436 ± 0.0006 Å
• b: 28.4436 ± 0.0006 Å
• c: 14.9962 ± 0.0009 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 12132.5 ± 0.8 ų
• Cell temperature: 293 K
• Ambient diffraction temperature: 293 K
• Number of distinct elements: 5
• Space group number: 141
• Hermann-Mauguin space group symbol: I 41/a m d :2
• Hall space group symbol: -I 4bd 2
• Residual factor R(I) for significantly intense reflections: 0.034
• Goodness-of-fit parameter for all reflections: 10.4
• Method of determination: powder diffraction
• Diffraction radiation wavelength: 1.5406 Å
• Diffraction radiation type: CuKa1
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No