Information card for entry 7021393

Structure parameters

• Formula: C128 H156 Lu2 N12 O6
• Calculated formula: C128 H156 Lu2 N12 O6
• SMILES: C1(Cc2ccccc2N(C)C)=[N](c2ccccc2)[Lu]23([N](c4c(cccc4C(C)C)C(C)C)=C(N3c3c(cccc3C(C)C)C(C)C)c3ccc(C4=[N](c5c(cccc5C(C)C)C(C)C)[Lu]56(OC(Cc7ccccc7N(C)C)=[N]6c6ccccc6)(N4c4c(cccc4C(C)C)C(C)C)([N](=C(O5)Cc4ccccc4N(C)C)c4ccccc4)[O]4CCCC4)cc3)([N](=C(O2)Cc2ccccc2N(C)C)c2ccccc2)(O1)[O]1CCCC1
• Title of publication: Synthesis, structure and reactivity of dinuclear rare earth metal bis(o-aminobenzyl) complexes bearing a 1,4-phenylenediamidinate co-ligand.
• Authors of publication: Li, Meng; Hong, Jianquan; Chen, Zhenxia; Zhou, Xigeng; Zhang, Lixin
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2013
• Journal volume: 42
• Journal issue: 23
• Pages of publication: 8288 - 8297
• a: 19.567 ± 0.008 Å
• b: 42.621 ± 0.016 Å
• c: 15.651 ± 0.006 Å
• α: 90°
• β: 93.747 ± 0.005°
• γ: 90°
• Cell volume: 13024 ± 9 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0986
• Residual factor for significantly intense reflections: 0.0513
• Weighted residual factors for significantly intense reflections: 0.1034
• Weighted residual factors for all reflections included in the refinement: 0.1112
• Goodness-of-fit parameter for all reflections included in the refinement: 1.003
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No