Information card for entry 7114261

Structure parameters

• Chemical name: [(bis(trimethylsilyl)amido)(tetrahydrofuran) (eta6,eta4-tetraphenylborato)ytterbium(II)]
• Formula: C34 H46 B N O Si2 Yb
• Calculated formula: C34 H46 B N O Si2 Yb
• SMILES: [Yb]123456789([O]%10CCCC%10)(N([Si](C)(C)C)[Si](C)(C)C)[c]%10([cH]5[cH]4[cH]3[cH]2[cH]1%10)[B]([C]16=[CH]9[CH]8=CC=[CH]71)(c1ccccc1)c1ccccc1
• Title of publication: Linkage isomerism and C???H activation in an ytterbium(ii) tetraphenylborate
• Authors of publication: Deacon, Glen B.; Forsyth, Craig M.
• Journal of publication: Chemical Communications
• Year of publication: 2002
• Journal issue: 21
• Pages of publication: 2522
• a: 9.621 ± 0.0001 Å
• b: 15.7886 ± 0.0002 Å
• c: 22.2434 ± 0.0002 Å
• α: 90°
• β: 92.931 ± 0.001°
• γ: 90°
• Cell volume: 3374.4 ± 0.06 ų
• Cell temperature: 123 ± 2 K
• Ambient diffraction temperature: 123 ± 2 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0676
• Residual factor for significantly intense reflections: 0.0333
• Weighted residual factors for significantly intense reflections: 0.0578
• Weighted residual factors for all reflections included in the refinement: 0.065
• Goodness-of-fit parameter for all reflections included in the refinement: 0.996
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No