Information card for entry 7101573

Structure parameters

• Formula: C9 H9 Er O6
• Calculated formula: C9 H6 Er O6
• Title of publication: An Unusually High Thermal Stability within a Novel Lanthanide 1,3,5-Cyclohexanetricarboxylate Framework: Synthesis, Structure, and Thermal Data.
• Authors of publication: D.T.de Lill; C.L.Cahill
• Journal of publication: Chemical Communications
• Year of publication: 2006
• Journal issue: 47
• a: 8.82 ± 0.003 Å
• b: 8.82 ± 0.003 Å
• c: 20.727 ± 0.013 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 1396.4 ± 1.1 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 2 K
• Number of distinct elements: 4
• 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: 0.0262
• Residual factor for significantly intense reflections: 0.0176
• Weighted residual factors for significantly intense reflections: 0.0414
• Weighted residual factors for all reflections included in the refinement: 0.0435
• Goodness-of-fit parameter for all reflections included in the refinement: 1.086
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No