Information card for entry 4077667

Structure parameters

• Formula: C22 H42 B10 O4 Yb
• Calculated formula: C22 H42 B10 O4 Yb
• SMILES: [Yb]1234567([C]89%10%11[C]%12%13%14([BH]%15%168[BH]8%17%12[BH]%12%18%13[BH]%139%14[BH]9%14%10[BH]%10%11%15[BH]%11%168[BH]8%17%12[BH]%18%139[BH]%14%10%118)C(C)(C)[c]81[cH]2[cH]3[c]15[c]48cccc1)([O](C)CC[O]6C)[O](C)CC[O]7C
• Title of publication: Carbon versus Silicon Bridges. Synthesis of a New Versatile Ligand and Its Applications in Organolanthanide Chemistry
• Authors of publication: Wang, Shaowu; Yang, Qingchuan; Mak, Thomas C. W.; Xie, Zuowei
• Journal of publication: Organometallics
• Year of publication: 2000
• Journal volume: 19
• Journal issue: 3
• Pages of publication: 334
• a: 20.354 ± 0.0019 Å
• b: 9.6415 ± 0.0007 Å
• c: 15.4 ± 0.0014 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3022.1 ± 0.5 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 5
• Space group number: 29
• Hermann-Mauguin space group symbol: P c a 21
• Hall space group symbol: P 2c -2ac
• Residual factor for all reflections: 0.0767
• Residual factor for significantly intense reflections: 0.0673
• Weighted residual factors for significantly intense reflections: 0.167
• Weighted residual factors for all reflections included in the refinement: 0.1744
• Goodness-of-fit parameter for all reflections included in the refinement: 1.141
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No