Information card for entry 4060184

Structure parameters

• Formula: C28 H48 Al Cl2 Sm
• Calculated formula: C28 H48 Al Cl2 Sm
• Title of publication: Lanthanide Metallocene Reactivity with Dialkyl Aluminum Chlorides: Modeling Reactions Used to Generate Isoprene Polymerization Catalysts
• Authors of publication: Evans, William J.; Champagne, Timothy M.; Giarikos, Dimitrios G.; Ziller, Joseph W.
• Journal of publication: Organometallics
• Year of publication: 2005
• Journal volume: 24
• Journal issue: 4
• Pages of publication: 570 - 579
• a: 12.5407 ± 0.0014 Å
• b: 13.0117 ± 0.0015 Å
• c: 20.34 ± 0.002 Å
• α: 71.891 ± 0.002°
• β: 79.783 ± 0.002°
• γ: 79.527 ± 0.002°
• Cell volume: 3076 ± 0.6 ų
• Cell temperature: 163 ± 2 K
• Ambient diffraction temperature: 163 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0463
• Residual factor for significantly intense reflections: 0.0306
• Weighted residual factors for significantly intense reflections: 0.0746
• Weighted residual factors for all reflections included in the refinement: 0.084
• Goodness-of-fit parameter for all reflections included in the refinement: 1.053
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No