Information card for entry 7007008

Structure parameters

• Formula: C8 H4 O7.33 Sc
• Calculated formula: C8 H4 O7.33333 Sc
• Title of publication: A scandium coordination polymer constructed from trimeric octahedral building blocks and 2,5-dihydroxyterephthalate.
• Authors of publication: Dietzel, Pascal D. C.; Blom, Richard; Fjellvåg, Helmer
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2006
• Journal issue: 17
• Pages of publication: 2055 - 2057
• a: 14.549 ± 0.0018 Å
• b: 14.549 ± 0.0018 Å
• c: 17.767 ± 0.004 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 3256.9 ± 0.9 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 4
• Space group number: 194
• Hermann-Mauguin space group symbol: P 63/m m c
• Hall space group symbol: -P 6c 2c
• Residual factor for all reflections: 0.0705
• Residual factor for significantly intense reflections: 0.0466
• Weighted residual factors for significantly intense reflections: 0.1236
• Weighted residual factors for all reflections included in the refinement: 0.131
• Goodness-of-fit parameter for all reflections included in the refinement: 0.906
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No