Information card for entry 4504986

Structure parameters

• Formula: C12 H12 Ce2 O18
• Calculated formula: C6 H2 Ce O9
• Title of publication: Reactive Microporous Rare-Earth Coordination Polymers that Exhibit Single-Crystal-to-Single-Crystal Dehydration and Rehydration
• Authors of publication: Michaelides, Adonis; Skoulika, Stavroula
• Journal of publication: Crystal Growth & Design
• Year of publication: 2005
• Journal volume: 5
• Journal issue: 2
• Pages of publication: 529
• a: 8.279 ± 0.002 Å
• b: 8.731 ± 0.003 Å
• c: 9.098 ± 0.003 Å
• α: 94.83 ± 0.04°
• β: 115.54 ± 0.01°
• γ: 111.93 ± 0.02°
• Cell volume: 526.3 ± 0.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0454
• Residual factor for significantly intense reflections: 0.0432
• Weighted residual factors for significantly intense reflections: 0.1096
• Weighted residual factors for all reflections included in the refinement: 0.1111
• Goodness-of-fit parameter for all reflections included in the refinement: 1.08
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No