Information card for entry 7200803

Structure parameters

• Common name: IM-19 dmf
• Formula: C5.275 H5.475 Ga0.5 N0.425 O2.925
• Calculated formula: C4 H2 Ga0.5 O2.5
• Title of publication: IM-19: a new flexible microporous gallium based-MOF framework with pressure- and temperature-dependent openings
• Authors of publication: Chaplais, Gérald; Simon-Masseron, Angélique; Porcher, Florence; Lecomte, Claude; Bazer-Bachi, Delphine; Bats, Nicolas; Patarin, Joël
• Journal of publication: Physical Chemistry Chemical Physics
• Year of publication: 2009
• Journal volume: 11
• Journal issue: 26
• Pages of publication: 5241 - 5245
• a: 6.712 ± 0.0004 Å
• b: 11.2486 ± 0.0011 Å
• c: 17.965 ± 0.0016 Å
• α: 90°
• β: 91.975 ± 0.007°
• γ: 90°
• Cell volume: 1355.6 ± 0.2 ų
• Cell temperature: 293 K
• Ambient diffraction temperature: 293 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: I 1 2/a 1
• Hall space group symbol: -I 2ya
• Residual factor for all reflections: 0.1151
• Residual factor for significantly intense reflections: 0.0873
• Weighted residual factors for significantly intense reflections: 0.1297
• Weighted residual factors for all reflections included in the refinement: 0.1302
• Goodness-of-fit parameter for significantly intense reflections: 9.41
• Goodness-of-fit parameter for all reflections included in the refinement: 7.97
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No