Information card for entry 1100950

Structure parameters

• Formula: C20 H22 Cu Dy N5 O13
• Calculated formula: C20 H22 Cu Dy N5 O13
• SMILES: [Dy]123456([O](CC)c7c8[O]1[Cu]19[O]2c2c([O]3CC)cccc2C=[N]9CC[N]1=Cc8ccc7)(ON(=[O]4)=O)(ON(=[O]5)=O)ON(=[O]6)=O
• Title of publication: Syntheses, Structures, and Magnetic Properties of Diphenoxo-Bridged MIILnIII Complexes Derived from N,N'-Ethylenebis(3-ethoxysalicylaldiimine) (M = Cu or Ni; Ln = Ce-Yb): Observation of Surprisingly Strong Exchange Interactions
• Authors of publication: Rajesh Koner; Hsin-Huang Lin; Ho-Hsiang Wei; Sasankasekhar Mohanta
• Journal of publication: Inorganic Chemistry
• Year of publication: 2005
• Journal volume: 44
• Pages of publication: 3524 - 3536
• a: 8.587 ± 0.0003 Å
• b: 13.758 ± 0.0005 Å
• c: 21.1665 ± 0.0007 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2500.61 ± 0.15 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 2 K
• Number of distinct elements: 6
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0264
• Residual factor for significantly intense reflections: 0.0205
• Weighted residual factors for significantly intense reflections: 0.0441
• Weighted residual factors for all reflections included in the refinement: 0.0452
• Goodness-of-fit parameter for all reflections included in the refinement: 1.025
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No