Information card for entry 4325507

Structure parameters

• Formula: C23 H26 N7 Ni O13 Pr
• Calculated formula: C23 H26 N7 Ni O13 Pr
• SMILES: C[O]1c2cccc3c2[O]2[Ni]45([N](=C3)CCC[N]4=Cc3cccc4c3[O]5[Pr]35612(ON(=[O]3)=O)(ON(=[O]5)=O)([O]4C)ON(=[O]6)=O)([N]#CC)[N]#CC
• Title of publication: Preparation, Crystal Structures, and Magnetic Features for a Series of Dinuclear [NiIILnIII] Schiff-Base Complexes: Evidence for Slow Relaxation of the Magnetization for the DyIII Derivative
• Authors of publication: Traian D. Pasatoiu; Jean-Pascal Sutter; Augustin M. Madalan; Fatima Zohra Chiboub Fellah; Carine Duhayon; Marius Andruh
• Journal of publication: Inorganic Chemistry
• Year of publication: 2011
• Journal volume: 50
• Pages of publication: 5890 - 5898
• a: 9.8353 ± 0.0003 Å
• b: 17.3914 ± 0.0007 Å
• c: 18.1987 ± 0.0006 Å
• α: 90°
• β: 91.811 ± 0.003°
• γ: 90°
• Cell volume: 3111.33 ± 0.19 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0772
• Residual factor for significantly intense reflections: 0.048
• Weighted residual factors for significantly intense reflections: 0.0942
• Weighted residual factors for all reflections included in the refinement: 0.1028
• Goodness-of-fit parameter for all reflections included in the refinement: 1.073
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No