Information card for entry 4106887

Structure parameters

• Formula: C71.4 H83.7 Dy2 Fe2 N15.7 O34.3
• Calculated formula: C71.4 H82.2 Dy2 Fe2 N15.7 O34.3
• Title of publication: Effect of Ligand Substitution on the Interaction Between Anisotropic Dy(III) Ions and57Fe Nuclei in Fe2Dy2 Coordination Clusters
• Authors of publication: Valeriu Mereacre; Amer Baniodeh; Christopher E. Anson; Annie K. Powell
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2011
• Journal volume: 133
• Pages of publication: 15335 - 15337
• a: 11.0959 ± 0.001 Å
• b: 14.0354 ± 0.0012 Å
• c: 14.3715 ± 0.0011 Å
• α: 85.882 ± 0.007°
• β: 89.474 ± 0.007°
• γ: 75.941 ± 0.007°
• Cell volume: 2165.4 ± 0.3 ų
• Cell temperature: 180 ± 2 K
• Ambient diffraction temperature: 180 ± 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: 0.0589
• Residual factor for significantly intense reflections: 0.0364
• Weighted residual factors for significantly intense reflections: 0.0612
• Weighted residual factors for all reflections included in the refinement: 0.0643
• Goodness-of-fit parameter for all reflections included in the refinement: 0.983
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No