Information card for entry 7018071

Structure parameters

• Formula: C8 H20 Br3 Ce O4
• Calculated formula: C8 H20 Br3 Ce O4
• Title of publication: Ionic liquid mediated routes to polydentate oxygen-donor adducts of cerium(iii) bromide.
• Authors of publication: Vasudevan, Kalyan V.; Smith, Nickolaus A.; Scott, Brian L.; Bennett, Bryan L.; Muenchausen, Ross E.; Gordon, John C.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2012
• Journal volume: 41
• Journal issue: 7
• Pages of publication: 1924 - 1927
• a: 10.0605 ± 0.0019 Å
• b: 13.14 ± 0.003 Å
• c: 12.781 ± 0.002 Å
• α: 90°
• β: 97.348 ± 0.002°
• γ: 90°
• Cell volume: 1675.7 ± 0.6 ų
• Cell temperature: 140 ± 1 K
• Ambient diffraction temperature: 140 ± 1 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: 0.032
• Residual factor for significantly intense reflections: 0.0227
• Weighted residual factors for significantly intense reflections: 0.0468
• Weighted residual factors for all reflections included in the refinement: 0.0485
• Goodness-of-fit parameter for all reflections included in the refinement: 1.259
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No