Information card for entry 2201515

Structure parameters

• Common name: Cerium trichloride heptahydrate
• Chemical name: Di-mu-chloro-bis[heptaaquacerium(III)] tetrachloride
• Formula: Ce2 Cl6 H28 O14
• Calculated formula: Ce2 Cl6 H28 O14
• SMILES: [OH2][Ce]1([OH2])([OH2])([OH2])([OH2])([OH2])([OH2])[Cl][Ce]([OH2])([OH2])([OH2])([OH2])([OH2])([OH2])([OH2])[Cl]1.[Cl-].[Cl-].[Cl-].[Cl-]
• Title of publication: Di-μ-chloro-bis[heptaaquacerium(III)] tetrachloride
• Authors of publication: Levason, William; Webster, Michael
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2002
• Journal volume: 58
• Journal issue: 9
• Pages of publication: i76 - i78
• a: 7.9018 ± 0.0005 Å
• b: 8.2096 ± 0.001 Å
• c: 9.1877 ± 0.001 Å
• α: 70.521 ± 0.007°
• β: 73.142 ± 0.006°
• γ: 81.66 ± 0.005°
• Cell volume: 536.98 ± 0.1 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 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: 0.0318
• Residual factor for significantly intense reflections: 0.0303
• Weighted residual factors for significantly intense reflections: 0.0791
• Weighted residual factors for all reflections included in the refinement: 0.0796
• Goodness-of-fit parameter for all reflections included in the refinement: 1.166
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes