Information card for entry 4504727

Structure parameters

• Chemical name: octaaquoytterbium(III) chloride hydrate 4,4-bipyridine complex
• Formula: C95 H189 Cl12 N19 O56.5 Yb4
• Calculated formula: C95 H76 Cl12 N19 O56.5 Yb4
• Title of publication: Hydrogen-Bonded 3-D Network Structures of Lanthanide Aquo Ions and 4,4‘-Bipyridine with Carbaborane Anions
• Authors of publication: Cunha-Silva, Luis; Westcott, Aleema; Whitford, Nina; Hardie, Michaele J.
• Journal of publication: Crystal Growth & Design
• Year of publication: 2006
• Journal volume: 6
• Journal issue: 3
• Pages of publication: 726
• a: 14.1542 ± 0.0001 Å
• b: 14.838 ± 0.0001 Å
• c: 37.0101 ± 0.0003 Å
• α: 97°
• β: 93.23°
• γ: 93.91°
• Cell volume: 7680.54 ± 0.1 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0687
• Residual factor for significantly intense reflections: 0.0513
• Weighted residual factors for significantly intense reflections: 0.1435
• Weighted residual factors for all reflections included in the refinement: 0.1567
• Goodness-of-fit parameter for all reflections included in the refinement: 1.024
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No