Information card for entry 2201426

Structure parameters

• Common name: Bis{[μ-η^5^:η^1^-2-(cyclopentadienyl)ethoxy](1,2-dimethoxyethane-O) (η^5^-cyclopentadienyl)yttrium}
• Formula: C32 H46 O6 Y2
• Calculated formula: C32 H46 O6 Y2
• SMILES: [Y]123456789%10([c]%11([cH]1[cH]2[cH]3[cH]4%11)CC[O]6[Y]12346%11%12%13%14([c]%15([cH]1[cH]2[cH]3[cH]4%15)CC[O]%10%12)([cH]1[cH]6[cH]%13[cH]%14[cH]1%11)[O](C)CCOC)([cH]1[cH]5[cH]7[cH]8[cH]91)[O](C)CCOC
• Title of publication: Bis[μ-η^5^:η^1^-2-(cyclopentadienyl)ethoxy]bis[(η^5^-cyclopentadienyl)(1,2-dimethoxyethane-κ<i>O</i>)yttrium]
• Authors of publication: Schumann, Herbert; Dechert, Sebastian; Pestova, Irina I.; Bochkarev, Mikhail N.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2002
• Journal volume: 58
• Journal issue: 12
• Pages of publication: m707 - m709
• a: 8.6073 ± 0.0002 Å
• b: 11.2146 ± 0.0001 Å
• c: 15.784 ± 0.0001 Å
• α: 90°
• β: 92.751 ± 0.001°
• γ: 90°
• Cell volume: 1521.83 ± 0.04 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 4
• 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: 0.0779
• Residual factor for significantly intense reflections: 0.0446
• Weighted residual factors for significantly intense reflections: 0.0785
• Weighted residual factors for all reflections included in the refinement: 0.0877
• Goodness-of-fit parameter for all reflections included in the refinement: 1.007
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No