Information card for entry 4073998

Structure parameters

• Formula: C82 H101 B2 Lu O7
• Calculated formula: C82 H101 B2 Lu O7
• SMILES: [Lu](c1ccccc1)([O]1CCCC1)([O]1CCCC1)([O]1CCCC1)([O]1CCCC1)[O]1CCCC1.[B-](c1ccccc1)(c1ccccc1)(c1ccccc1)c1ccccc1.[B-](c1ccccc1)(c1ccccc1)(c1ccccc1)c1ccccc1.O1CCCC1.O1CCCC1
• Title of publication: Cationic Aryl Complexes of the Rare-Earth Metals
• Authors of publication: Zeimentz, Peter M.; Okuda, Jun
• Journal of publication: Organometallics
• Year of publication: 2007
• Journal volume: 26
• Journal issue: 25
• Pages of publication: 6388
• a: 12.3689 ± 0.0015 Å
• b: 13.8132 ± 0.0016 Å
• c: 41.361 ± 0.005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 7066.7 ± 1.5 ų
• Cell temperature: 130 K
• Ambient diffraction temperature: 130 K
• Number of distinct elements: 5
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.1024
• Residual factor for significantly intense reflections: 0.0692
• Weighted residual factors for significantly intense reflections: 0.145
• Weighted residual factors for all reflections included in the refinement: 0.1555
• Goodness-of-fit parameter for all reflections included in the refinement: 1.019
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No