Information card for entry 4075201

Structure parameters

• Formula: C29 H49 Lu O2 Si2
• Calculated formula: C29 H49 Lu O2 Si2
• SMILES: [Lu]([O]1CCCC1)([O]1CCCC1)(C(c1ccccc1)c1ccccc1)(C[Si](C)(C)C)C[Si](C)(C)C
• Title of publication: Organometallic Compounds of the Lanthanides. 179.1Synthesis and Structural Characterization of a Mixed Alkyl (Benzhydryl, Trimethylsilylmethyl) Lutetium Complex
• Authors of publication: Schumann, Herbert; Freckmann, Dominique M. M.; Dechert, Sebastian
• Journal of publication: Organometallics
• Year of publication: 2006
• Journal volume: 25
• Journal issue: 10
• Pages of publication: 2696
• a: 16.7997 ± 0.0003 Å
• b: 10.773 ± 0.0002 Å
• c: 19.5836 ± 0.0001 Å
• α: 90°
• β: 112.997 ± 0.001°
• γ: 90°
• Cell volume: 3262.62 ± 0.09 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0585
• Residual factor for significantly intense reflections: 0.0365
• Weighted residual factors for significantly intense reflections: 0.0709
• Weighted residual factors for all reflections included in the refinement: 0.0786
• Goodness-of-fit parameter for all reflections included in the refinement: 1.003
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No