Information card for entry 4348935

Structure parameters

• Formula: C68 H66 Dy Mn4 N8 Na O29
• Calculated formula: C68 H72 Dy Mn4 N8 Na O29
• Title of publication: The Nature of the Bridging Anion Controls the Single-Molecule Magnetic Properties of DyX₄M 12-Metallacrown-4 Complexes.
• Authors of publication: Boron, 3rd, Thaddeus T; Lutter, Jacob C.; Daly, Connor I.; Chow, Chun Y.; Davis, Andrew H.; Nimthong-Roldán, Arunpatcha; Zeller, Matthias; Kampf, Jeff W.; Zaleski, Curtis M.; Pecoraro, Vincent L.
• Journal of publication: Inorganic chemistry
• Year of publication: 2016
• Journal volume: 55
• Journal issue: 20
• Pages of publication: 10597 - 10607
• a: 14.1657 ± 0.0001 Å
• b: 16.5718 ± 0.0001 Å
• c: 16.7075 ± 0.0001 Å
• α: 90°
• β: 95.929 ± 0.001°
• γ: 90°
• Cell volume: 3901.12 ± 0.04 ų
• Cell temperature: 85 ± 2 K
• Ambient diffraction temperature: 85 ± 2 K
• Number of distinct elements: 7
• Space group number: 7
• Hermann-Mauguin space group symbol: P 1 n 1
• Hall space group symbol: P -2yac
• Residual factor for all reflections: 0.0389
• Residual factor for significantly intense reflections: 0.0372
• Weighted residual factors for significantly intense reflections: 0.0974
• Weighted residual factors for all reflections included in the refinement: 0.0993
• Goodness-of-fit parameter for all reflections included in the refinement: 1.006
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No