Information card for entry 7045558

Structure parameters

• Formula: C58 H92 N5 Si2 Yb
• Calculated formula: C58 H92 N5 Si2 Yb
• SMILES: CC(C)c1cccc(c1[N]1=C(C)C=C(C)N(CCn2c(C)ccc2C)[Yb]21(C[Si](C)(C)C)[N](c1c(C(C)C)cccc1C(C)C)=C(C[Si](C)(C)C)N2c1c(C(C)C)cccc1C(C)C)C(C)C
• Title of publication: Versatile reactivities of rare-earth metal dialkyl complexes supported by a neutral pyrrolyl-functionalized β-diketiminato ligand.
• Authors of publication: Zhu, Xiancui; Li, Yang; Guo, Dianjun; Wang, Shaowu; Wei, Yun; Zhou, Shuangliu
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2018
• Journal volume: 47
• Journal issue: 11
• Pages of publication: 3947 - 3957
• a: 12.0511 ± 0.0009 Å
• b: 20.7963 ± 0.0015 Å
• c: 23.9256 ± 0.0017 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 5996.2 ± 0.8 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.085
• Residual factor for significantly intense reflections: 0.0429
• Weighted residual factors for significantly intense reflections: 0.071
• Weighted residual factors for all reflections included in the refinement: 0.0831
• Goodness-of-fit parameter for all reflections included in the refinement: 0.922
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No