Information card for entry 7047013

Structure parameters

• Formula: C25 H53 N2 O2 Sc Si3
• Calculated formula: C25 H53 N2 O2 Sc Si3
• Title of publication: Bis(oxazoline)-derived N-heterocyclic carbene ligated rare-earth metal complexes: synthesis, structure, and polymerization performance.
• Authors of publication: Pan, Yu; Zhao, Aijing; Li, Yang; Li, Wenqiang; So, Yat-Ming; Yan, Xiaoming; He, Gaohong
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2018
• Journal volume: 47
• Journal issue: 39
• Pages of publication: 13815 - 13823
• a: 12.604 ± 0.003 Å
• b: 9.977 ± 0.002 Å
• c: 13.129 ± 0.003 Å
• α: 90 ± 0.03°
• β: 92.97 ± 0.03°
• γ: 90 ± 0.03°
• Cell volume: 1648.8 ± 0.6 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 6
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.0192
• Residual factor for significantly intense reflections: 0.0184
• Weighted residual factors for significantly intense reflections: 0.0508
• Weighted residual factors for all reflections included in the refinement: 0.0513
• Goodness-of-fit parameter for all reflections included in the refinement: 1.037
• Diffraction radiation wavelength: 0.71076 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No