Information card for entry 4310558

Structure parameters

• Formula: C12 H32 I3 Lu O4
• Calculated formula: C12 H32 I3 Lu O4
• SMILES: C(C)(C)[OH][Lu](I)([OH]C(C)C)(I)([OH]C(C)C)[OH]C(C)C.[I-]
• Title of publication: Auto-ionization in Lutetium Iodide Complexes: Effect of the Ionic Radius on Lanthanide-Iodide Binding
• Authors of publication: Garth R. Giesbrecht; John C. Gordon; David L. Clark; Brian L. Scott
• Journal of publication: Inorganic Chemistry
• Year of publication: 2004
• Journal volume: 43
• Pages of publication: 1065 - 1070
• a: 12.565 ± 0.004 Å
• b: 12.565 ± 0.004 Å
• c: 32.192 ± 0.015 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 5082 ± 3 ų
• Cell temperature: 203 ± 2 K
• Ambient diffraction temperature: 203 ± 2 K
• Number of distinct elements: 5
• Space group number: 122
• Hermann-Mauguin space group symbol: I -4 2 d
• Hall space group symbol: I -4 2bw
• Residual factor for all reflections: 0.026
• Residual factor for significantly intense reflections: 0.0251
• Weighted residual factors for significantly intense reflections: 0.057
• Weighted residual factors for all reflections included in the refinement: 0.0573
• Goodness-of-fit parameter for all reflections included in the refinement: 1.567
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No