Information card for entry 4063937

Structure parameters

• Formula: C18 H41 Al N Sc Si2
• Calculated formula: C18 H41 Al N Sc Si2
• SMILES: [Sc]12345(N([SiH](C)C)[SiH](C)C)([CH3][Al]([CH3]1)(C)C)[c]1([c]2([c]3([c]4([c]51C)C)C)C)C
• Title of publication: Half-Sandwich Scandium Bis(amide) Complexes as Efficient Catalyst Precursors for Syndiospecific Polymerization of Styrene
• Authors of publication: Luo, Yunjie; Feng, Xiaoying; Wang, Yibin; Fan, Shimin; Chen, Jue; Lei, Yinlin; Liang, Hongze
• Journal of publication: Organometallics
• Year of publication: 2011
• Journal volume: 30
• Journal issue: 12
• Pages of publication: 3270 - 3274
• a: 9.7864 ± 0.0011 Å
• b: 10.5601 ± 0.0014 Å
• c: 13.801 ± 0.003 Å
• α: 85.161 ± 0.019°
• β: 78.719 ± 0.017°
• γ: 65.44 ± 0.013°
• Cell volume: 1272.2 ± 0.4 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1067
• Residual factor for significantly intense reflections: 0.0825
• Weighted residual factors for significantly intense reflections: 0.1761
• Weighted residual factors for all reflections included in the refinement: 0.1889
• Goodness-of-fit parameter for all reflections included in the refinement: 1.176
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No