Information card for entry 4301499

Structure parameters

• Formula: C40 H54 B2 N16 O Yb2
• Calculated formula: C40 H54 B2 N16 O Yb2
• SMILES: [Yb]1234(Nc5ccc[n](c5)[Yb]67([n]8n([BH](n9[n]7c(cc9C)C)n7[n]6c(cc7C)C)c(C)cc8C)(Nc6[n]3cccc6)O4)[n]3n([BH](n4[n]1c(cc4C)C)n1[n]2c(cc1C)C)c(C)cc3C
• Title of publication: Synthesis of Mixed Cp/TpMe2 Lanthanide Complexes from Lanthanocene Precursors and their Structures and Reactivities
• Authors of publication: Fuyan Han; Jie Zhang; Yanan Han; Zhengxing Zhang; Zhenxia Chen; Linhong Weng; Xigeng Zhou
• Journal of publication: Inorganic Chemistry
• Year of publication: 2009
• Journal volume: 48
• Pages of publication: 1774 - 1781
• a: 14.988 ± 0.006 Å
• b: 20.357 ± 0.008 Å
• c: 17.065 ± 0.007 Å
• α: 90°
• β: 115.328 ± 0.005°
• γ: 90°
• Cell volume: 4706 ± 3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• 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: 0.0506
• Residual factor for significantly intense reflections: 0.0324
• Weighted residual factors for significantly intense reflections: 0.0662
• Weighted residual factors for all reflections included in the refinement: 0.0706
• Goodness-of-fit parameter for all reflections included in the refinement: 0.947
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No