Information card for entry 4077747

Structure parameters

• Formula: C28 H38 Yb2
• Calculated formula: C28 H38 Yb2
• SMILES: [Yb]123456789%10%11([c]%12([c]1([c]2([c]3([c]4%12C)C)C)C)C)[CH]12=[CH]35[Yb]45%12%13%14%15%16%17%181([c]1([c]%13([c]%12([c]5([c]41C)C)C)C)C)[CH]63=[CH]7%14[CH]8%15=[CH]9%16[CH]%10%17=[CH]%112%18
• Title of publication: Synthesis, Structure, and Reactivity of Unsolvated Triple-Decked Bent Metallocenes of Divalent Europium and Ytterbium
• Authors of publication: Evans, William J.; Johnston, Matthew A.; Greci, Michael A.; Ziller, Joseph W.
• Journal of publication: Organometallics
• Year of publication: 1999
• Journal volume: 18
• Journal issue: 8
• Pages of publication: 1460
• a: 13.338 ± 0.002 Å
• b: 13.549 ± 0.002 Å
• c: 15.815 ± 0.002 Å
• α: 114.772 ± 0.007°
• β: 93.948 ± 0.011°
• γ: 90.803 ± 0.014°
• Cell volume: 2586 ± 0.7 ų
• Cell temperature: 163 K
• Ambient diffraction temperature: 163 K
• Number of distinct elements: 3
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0798
• Residual factor for significantly intense reflections: 0.0604
• Weighted residual factors for all reflections: 0.1777
• Weighted residual factors for significantly intense reflections: 0.1607
• Goodness-of-fit parameter for all reflections: 1.032
• Goodness-of-fit parameter for significantly intense reflections: 1.061
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No