Information card for entry 4301490

Structure parameters

• Formula: C25 H32 B N6 Yb
• Calculated formula: C25 H32 B N6 Yb
• SMILES: [Yb]123456789([n]%10n([BH](n%11[n]1c(cc%11C)C)n1nc(cc1C)C)c(C)cc%10C)([cH]1[cH]5[cH]4[cH]3[cH]21)[cH]1[cH]9[cH]8[cH]7[cH]61
• 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: 8.747 ± 0.004 Å
• b: 21.798 ± 0.009 Å
• c: 12.859 ± 0.005 Å
• α: 90°
• β: 96.273 ± 0.004°
• γ: 90°
• Cell volume: 2437.1 ± 1.8 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 9
• Hermann-Mauguin space group symbol: C 1 c 1
• Hall space group symbol: C -2yc
• Residual factor for all reflections: 0.0373
• Residual factor for significantly intense reflections: 0.0364
• Weighted residual factors for significantly intense reflections: 0.0898
• Weighted residual factors for all reflections included in the refinement: 0.0904
• Goodness-of-fit parameter for all reflections included in the refinement: 1.132
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No