Information card for entry 4320650

Structure parameters

• Formula: C43 H71 La Si3
• Calculated formula: C43 H71 La Si3
• SMILES: [La]123456789%10%11%12([c]%13([c]1([c]2([c]3([c]4%13[Si](C)(C)C)C)C)C)C)([c]1([c]5([c]6([c]7([c]81[Si](C)(C)C)C)C)C)C)[c]1([c]9([c]%10([c]%11([c]%121[Si](C)(C)C)C)C)C)C.c1(ccccc1)C
• Title of publication: Synthesis and Structure of Tris(alkyl- and silyl-tetramethylcyclopentadienyl) Complexes of Lanthanum
• Authors of publication: William J. Evans; Benjamin L. Davis; Joseph W. Ziller
• Journal of publication: Inorganic Chemistry
• Year of publication: 2001
• Journal volume: 40
• Pages of publication: 6341 - 6348
• a: 10.2192 ± 0.0007 Å
• b: 10.2734 ± 0.0007 Å
• c: 20.4975 ± 0.0014 Å
• α: 91.811 ± 0.001°
• β: 98.394 ± 0.001°
• γ: 96.136 ± 0.001°
• Cell volume: 2114.3 ± 0.3 ų
• Cell temperature: 158 ± 2 K
• Ambient diffraction temperature: 158 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.024
• Residual factor for significantly intense reflections: 0.0226
• Weighted residual factors for significantly intense reflections: 0.0593
• Weighted residual factors for all reflections included in the refinement: 0.0637
• Goodness-of-fit parameter for all reflections included in the refinement: 1.1
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No