Information card for entry 7201011

Structure parameters

• Formula: C10 H10 O10 S2 Sc2
• Calculated formula: C10 H10 O10 S2 Sc2
• Title of publication: 3D scandium and yttrium arenedisulfonate MOF materials as highly thermally stable bifunctional heterogeneous catalysts
• Authors of publication: Perles, Josefina; Snejko, Natalia; Iglesias, Marta; Monge, M. Ángeles
• Journal of publication: Journal of Materials Chemistry
• Year of publication: 2009
• Journal volume: 19
• Journal issue: 36
• Pages of publication: 6504
• a: 5.2459 ± 0.0007 Å
• b: 10.8963 ± 0.0014 Å
• c: 13.2466 ± 0.0017 Å
• α: 86.026 ± 0.002°
• β: 81.604 ± 0.002°
• γ: 85.685 ± 0.002°
• Cell volume: 745.64 ± 0.17 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1368
• Residual factor for significantly intense reflections: 0.0995
• Weighted residual factors for significantly intense reflections: 0.2494
• Weighted residual factors for all reflections included in the refinement: 0.2926
• Goodness-of-fit parameter for all reflections included in the refinement: 0.972
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No