Information card for entry 7112775

Structure parameters

• Formula: C37 H41 Li N3 O Sn Yb
• Calculated formula: C37 H41 Li N3 O Sn Yb
• SMILES: c12ccc(c[n]1[Li]13([n]4c(ccc(c4)C)[Sn]23(c2ccc(c[n]12)C)[Yb]123456789%10%11%12([cH]%13[cH]1[cH]2[cH]3[cH]4%13)([cH]1[cH]5[cH]6[cH]7[cH]81)[cH]1[cH]%12[cH]%11[cH]%10[cH]91)[O]1CCCC1)C
• Title of publication: Tin‒lanthanoid donor‒acceptor bonds
• Authors of publication: Zeckert, Kornelia; Zahn, Stefan; Kirchner, Barbara
• Journal of publication: Chemical Communications (Cambridge, United Kingdom)
• Year of publication: 2010
• Journal volume: 46
• Journal issue: 15
• Pages of publication: 2638 - 2640
• a: 12.1128 ± 0.0004 Å
• b: 14.9906 ± 0.0005 Å
• c: 19.3565 ± 0.0006 Å
• α: 87.54 ± 0.003°
• β: 74.044 ± 0.003°
• γ: 87.79 ± 0.003°
• Cell volume: 3374.9 ± 0.2 ų
• Cell temperature: 130 ± 2 K
• Ambient diffraction temperature: 130 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0942
• Residual factor for significantly intense reflections: 0.0491
• Weighted residual factors for significantly intense reflections: 0.1165
• Weighted residual factors for all reflections included in the refinement: 0.1255
• Goodness-of-fit parameter for all reflections included in the refinement: 0.866
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Duplicate of: 7105404
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No