Information card for entry 7025013

Structure parameters

• Formula: C70 H112 I2 N6 O2 Yb2
• Calculated formula: C70 H112 I2 N6 O2 Yb2
• SMILES: C1(=[N](c2c(cccc2C(C)C)C(C)C)[Yb]2([I][Yb]3([N](c4c(cccc4C(C)C)C(C)C)=C(N3c3c(cccc3C(C)C)C(C)C)N(C(C)C)C(C)C)([I]2)[O]2CCCC2)(N1c1c(cccc1C(C)C)C(C)C)[O]1CCCC1)N(C(C)C)C(C)C
• Title of publication: Low coordinate lanthanide(II) complexes supported by bulky guanidinato and amidinato ligands.
• Authors of publication: Heitmann, Dennis; Jones, Cameron; Mills, David P.; Stasch, Andreas
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2010
• Journal volume: 39
• Journal issue: 7
• Pages of publication: 1877 - 1882
• a: 15.374 ± 0.003 Å
• b: 10.524 ± 0.002 Å
• c: 23.481 ± 0.005 Å
• α: 90°
• β: 105.23 ± 0.03°
• γ: 90°
• Cell volume: 3665.7 ± 1.4 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 6
• 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: 0.1456
• Residual factor for significantly intense reflections: 0.0872
• Weighted residual factors for significantly intense reflections: 0.18
• Weighted residual factors for all reflections included in the refinement: 0.2011
• Goodness-of-fit parameter for all reflections included in the refinement: 1.087
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No