Information card for entry 4309314

Structure parameters

• Formula: C26 H46 B La
• Calculated formula: C26 H46 B La
• SMILES: [La]12345678([H][B](CC)(CC)CC)([c]9([c]1([c]2([c]3([c]49C)C)C)C)C)[c]1([c]8([c]7([c]6([c]51C)C)C)C)C
• Title of publication: Trialkylboron/Lanthanide Metallocene Hydride Chemistry: Polydentate Bridging of (HBEt3)- to Lanthanum
• Authors of publication: William J. Evans; Jeremy M. Perotti; Joseph W. Ziller
• Journal of publication: Inorganic Chemistry
• Year of publication: 2005
• Journal volume: 44
• Pages of publication: 5820 - 5825
• a: 12.0975 ± 0.0014 Å
• b: 14.6414 ± 0.0017 Å
• c: 15.1196 ± 0.0017 Å
• α: 90°
• β: 104.69 ± 0.002°
• γ: 90°
• Cell volume: 2590.5 ± 0.5 ų
• Cell temperature: 163 ± 2 K
• Ambient diffraction temperature: 163 ± 2 K
• Number of distinct elements: 4
• 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: 0.024
• Residual factor for significantly intense reflections: 0.0184
• Weighted residual factors for significantly intense reflections: 0.0456
• Weighted residual factors for all reflections included in the refinement: 0.0488
• Goodness-of-fit parameter for all reflections included in the refinement: 1.055
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No