Information card for entry 4063616

Structure parameters

• Formula: C26 H49 B N O Sc Si2
• Calculated formula: C26 H49 B N O Sc Si2
• Title of publication: 1,2-Azaborolyl-Ligated Half-Sandwich Complexes of Scandium(III) and Lutetium(III): Synthesis, Structures, and Syndiotactic Polymerization of Styrene
• Authors of publication: Fang, Xiangdong; Li, Xiaofang; Hou, Zhaomin; Assoud, Jalil; Zhao, Rui
• Journal of publication: Organometallics
• Year of publication: 2009
• Journal volume: 28
• Journal issue: 2
• Pages of publication: 517 - 522
• a: 11.397 ± 0.0005 Å
• b: 18.2738 ± 0.0008 Å
• c: 15.0873 ± 0.0007 Å
• α: 90°
• β: 95.804 ± 0.001°
• γ: 90°
• Cell volume: 3126.1 ± 0.2 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 7
• 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: 0.0612
• Residual factor for significantly intense reflections: 0.0449
• Weighted residual factors for significantly intense reflections: 0.0979
• Weighted residual factors for all reflections included in the refinement: 0.1053
• Goodness-of-fit parameter for all reflections included in the refinement: 1.153
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No