Information card for entry 7104367

Structure parameters

• Formula: C12 O12 Sc2
• Calculated formula: C12 O12 Sc2
• Title of publication: A new scandium metal organic framework built up from octadecasil zeolitic cages as heterogeneous catalyst.
• Authors of publication: Gándara, Felipe; Gómez-Lor, Berta; Iglesias, Marta; Snejko, Natalia; Gutiérrez-Puebla, Enrique; Monge, Angeles
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2009
• Journal volume: 34
• Journal issue: 17
• Pages of publication: 2393 - 2395
• a: 15.2431 ± 0.0011 Å
• b: 15.2431 ± 0.0011 Å
• c: 20.579 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 4141 ± 0.6 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 3
• Space group number: 167
• Hermann-Mauguin space group symbol: R -3 c :H
• Hall space group symbol: -R 3 2"c
• Residual factor for all reflections: 0.0466
• Residual factor for significantly intense reflections: 0.0425
• Weighted residual factors for significantly intense reflections: 0.1178
• Weighted residual factors for all reflections included in the refinement: 0.1205
• Goodness-of-fit parameter for all reflections included in the refinement: 1.142
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No