Information card for entry 7713552

Structure parameters

• Formula: C51 H58 N4 P Sc
• Calculated formula: C51 H58 N4 P Sc
• Title of publication: Phosphine-functionalized amidinate ligated rare-earth metal complexes for highly 3,4-selective living polymerization of 1,3-conjugated dienes.
• Authors of publication: You, Fen; Wang, Jixing; Liu, Hui; Kang, Xiaohui; Shi, Xiaochao
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2023
• a: 11.8185 ± 0.0012 Å
• b: 12.4335 ± 0.0015 Å
• c: 15.9472 ± 0.0017 Å
• α: 89.192 ± 0.004°
• β: 71.996 ± 0.004°
• γ: 87.743 ± 0.004°
• Cell volume: 2226.9 ± 0.4 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 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: 0.1831
• Residual factor for significantly intense reflections: 0.0955
• Weighted residual factors for significantly intense reflections: 0.2159
• Weighted residual factors for all reflections included in the refinement: 0.2731
• Goodness-of-fit parameter for all reflections included in the refinement: 1.001
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No