Information card for entry 2018454

Structure parameters

• Chemical name: (μ-1,2-Dimethoxyethane-κ^2^<i>O</i>:<i>O</i>')bis[(1,2-dimethoxyethane- κ^2^<i>O</i>,<i>O</i>')tris(1,1,1,5,5,5-hexafluoro-4-oxopent-2-en-2-olato- κ^2^<i>O</i>,<i>O</i>')cerium(III)]
• Formula: C42 H36 Ce2 F36 O18
• Calculated formula: C42 H36 Ce2 F36 O18
• Title of publication: (μ-1,2-Dimethoxyethane-κ^2^<i>O</i>:<i>O</i>')bis[(1,2-dimethoxyethane-κ^2^<i>O</i>,<i>O</i>')tris(1,1,1,5,5,5-hexafluoro-4-oxopent-2-en-2-olato-κ^2^<i>O</i>,<i>O</i>')cerium(III)]
• Authors of publication: Fatila, Elisabeth M.; Jennings, Michael C.; Lough, Alan; Preuss, Kathryn E.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2012
• Journal volume: 68
• Journal issue: 4
• Pages of publication: m100 - m103
• a: 9.1135 ± 0.0018 Å
• b: 13.818 ± 0.003 Å
• c: 24.971 ± 0.005 Å
• α: 90°
• β: 95.16 ± 0.03°
• γ: 90°
• Cell volume: 3131.9 ± 1.1 ų
• Cell temperature: 147 ± 2 K
• Ambient diffraction temperature: 147 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0492
• Residual factor for significantly intense reflections: 0.0347
• Weighted residual factors for significantly intense reflections: 0.0609
• Weighted residual factors for all reflections included in the refinement: 0.0654
• Goodness-of-fit parameter for all reflections included in the refinement: 1.082
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes