Information card for entry 4325953

Structure parameters

• Formula: C144 H218 Cl12 Cu8 Dy4 N16 O29
• Calculated formula: C144 H218 Cl12 Cu8 Dy4 N16 O29
• Title of publication: Benzoxazole-Based Heterometallic Dodecanuclear Complex [DyIII4CuII8] with Single-Molecule-Magnet Behavior
• Authors of publication: Olga Iasco; Ghenadie Novitchi; Erwann Jeanneau; Wolfgang Wernsdorfer; Dominique Luneau
• Journal of publication: Inorganic Chemistry
• Year of publication: 2011
• Journal volume: 50
• Pages of publication: 7373 - 7375
• a: 34.386 ± 0.002 Å
• b: 15.202 ± 0.0007 Å
• c: 36.121 ± 0.001 Å
• α: 90°
• β: 90.893 ± 0.004°
• γ: 90°
• Cell volume: 18879.5 ± 1.5 ų
• Cell temperature: 110 K
• Ambient diffraction temperature: 110 K
• Number of distinct elements: 7
• 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: 0.0935
• Residual factor for significantly intense reflections: 0.0732
• Weighted residual factors for all reflections: 0.1955
• Weighted residual factors for significantly intense reflections: 0.1678
• Weighted residual factors for all reflections included in the refinement: 0.1955
• Goodness-of-fit parameter for all reflections included in the refinement: 1.0134
• Diffraction radiation wavelength: 1.5418 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No