Information card for entry 7016602

Structure parameters

• Formula: C47 H46 N2 S Yb
• Calculated formula: C47 H46 N2 S Yb
• SMILES: c12cccc3c4ccc[s]4[Yb]456789%10%11([c]%12%13[c]7([cH]6[cH]5[cH]4%12)cccc%13)([c]45cccc[c]%115[cH]%10[cH]9[cH]84)([n]23)[N](=C1)c1c(cccc1C(C)C)C(C)C.c1(ccccc1)C
• Title of publication: Steric control on the redox chemistry of (η(5)-C(9)H(7))(2)Yb(II)(THF)(2) by 6-aryl substituted iminopyridines.
• Authors of publication: Trifonov, Alexander A.; Shestakov, Boris G.; Gudilenkov, Ivan D.; Fukin, Georgy K.; Giambastiani, Giuliano; Bianchini, Claudio; Rossin, Andrea; Luconi, Lapo; Filippi, Jonathan; Sorace, Lorenzo
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2011
• Journal volume: 40
• Journal issue: 40
• Pages of publication: 10568 - 10575
• a: 23.6885 ± 0.0007 Å
• b: 10.4564 ± 0.0003 Å
• c: 15.6524 ± 0.0005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3877 ± 0.2 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 33
• Hermann-Mauguin space group symbol: P n a 21
• Hall space group symbol: P 2c -2n
• Residual factor for all reflections: 0.019
• Residual factor for significantly intense reflections: 0.0184
• Weighted residual factors for significantly intense reflections: 0.0458
• Weighted residual factors for all reflections included in the refinement: 0.0461
• Goodness-of-fit parameter for all reflections included in the refinement: 1.067
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No