Information card for entry 2240618

Structure parameters

• Common name: Ytterbium (III) Chloride Hexahydrate
• Chemical name: Hexaaquadichloridoytterbium(III) chloride
• Formula: Cl3 H12 O6 Yb
• Calculated formula: Cl3 H12 O6 Yb
• SMILES: [OH2][Yb]([OH2])([OH2])(Cl)([OH2])([OH2])([OH2])Cl.[Cl-]
• Title of publication: Crystal structure of hexaaquadichloridoytterbium(III) chloride
• Authors of publication: Knopf, Kevin M.; Crundwell, Guy; Westcott, Barry L.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2015
• Journal volume: 71
• Journal issue: 6
• Pages of publication: i5
• a: 7.8158 ± 0.0011 Å
• b: 6.4651 ± 0.0003 Å
• c: 12.725 ± 0.0018 Å
• α: 90°
• β: 131.45 ± 0.02°
• γ: 90°
• Cell volume: 481.95 ± 0.18 ų
• Cell temperature: 110 ± 2 K
• Ambient diffraction temperature: 110 ± 2 K
• Number of distinct elements: 4
• Space group number: 13
• Hermann-Mauguin space group symbol: P 1 2/c 1
• Hall space group symbol: -P 2yc
• Residual factor for all reflections: 0.0186
• Residual factor for significantly intense reflections: 0.0178
• Weighted residual factors for significantly intense reflections: 0.0406
• Weighted residual factors for all reflections included in the refinement: 0.041
• Goodness-of-fit parameter for all reflections included in the refinement: 1.117
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes