Information card for entry 7711405

Structure parameters

• Formula: C25 H32 N7 O14 Yb Zn
• Calculated formula: C25 H32 N7 O14 Yb Zn
• SMILES: C[O]1c2cccc3c2[O]2[Yb]4561([O]1c7c(C=[N]8CC(C[N](=C3)[Zn]218ON(=O)=O)(C)C)cccc7[O]4C)([OH2])(ON(=[O]6)=O)ON(=[O]5)=O.C(#N)C.C(#N)C
• Title of publication: Single molecule magnet behavior and luminescence of {Ln₄} and {LnZn} complexes.
• Authors of publication: Peng, Guo; Yang, Qi; Chen, Yue; Dong, Xiang-Tao; Zhang, Zaichao; Ren, Xiao-Ming
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2022
• Journal volume: 51
• Journal issue: 33
• Pages of publication: 12484 - 12493
• a: 9.1368 ± 0.0005 Å
• b: 13.0737 ± 0.0008 Å
• c: 14.5753 ± 0.0008 Å
• α: 73.361 ± 0.002°
• β: 88.269 ± 0.002°
• γ: 84.129 ± 0.002°
• Cell volume: 1659.39 ± 0.16 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0447
• Residual factor for significantly intense reflections: 0.0307
• Weighted residual factors for significantly intense reflections: 0.0493
• Weighted residual factors for all reflections included in the refinement: 0.0533
• Goodness-of-fit parameter for all reflections included in the refinement: 1.05
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No