Information card for entry 4316786

Structure parameters

• Formula: C79 H83 Mn4 N17 O26 Y2
• Calculated formula: C75 H75.5 Mn4 N16 O24.88 Y2
• Title of publication: A Mixed 3d-4f 14-Metallacrown-5 Complex That Displays Slow Magnetic Relaxation through Geometric Control of Magnetoanisotropy
• Authors of publication: Thaddeus T. Boron; Jeff W. Kampf; Vincent L. Pecoraro
• Journal of publication: Inorganic Chemistry
• Year of publication: 2010
• Journal volume: 49
• Pages of publication: 9104 - 9106
• a: 28.996 ± 0.003 Å
• b: 16.7033 ± 0.0017 Å
• c: 18.434 ± 0.0019 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 8928.1 ± 1.6 ų
• Cell temperature: 85 ± 2 K
• Ambient diffraction temperature: 85 ± 2 K
• Number of distinct elements: 6
• Space group number: 58
• Hermann-Mauguin space group symbol: P n n m
• Hall space group symbol: -P 2 2n
• Residual factor for all reflections: 0.0813
• Residual factor for significantly intense reflections: 0.0633
• Weighted residual factors for significantly intense reflections: 0.1957
• Weighted residual factors for all reflections included in the refinement: 0.2118
• Goodness-of-fit parameter for all reflections included in the refinement: 1.074
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No