Information card for entry 2215561

Structure parameters

• Chemical name: μ-Sulfato-1κ<i>O</i>:2κ<i>O</i>-μ-oxo-bis[tris(2-pyridylmethyl)amine-κ^4^ <i>N</i>,<i>N</i>',<i>N</i>",<i>N</i>'"]diiron(III) diperchlorate acetonitrile/water (0.75/0.25) solvate
• Formula: C150 H155 Cl8 Fe8 N35 O53 S4
• Calculated formula: C150 H155 Cl8 Fe8 N35 O53 S4
• Title of publication: μ-Sulfato-1κ<i>O</i>:2κ<i>O</i>-μ-oxo-bis[tris(2-pyridylmethyl)amine-κ^4^<i>N</i>,<i>N</i>',<i>N</i>'',<i>N</i>''']diiron(III) diperchlorate acetonitrile/water (0.75/0.25) solvate
• Authors of publication: Smith, Christine M.; Norman, Richard E.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 10
• Pages of publication: m2480 - m2481
• a: 12.7031 ± 0.001 Å
• b: 24.477 ± 0.003 Å
• c: 13.6165 ± 0.0011 Å
• α: 90°
• β: 103.357 ± 0.005°
• γ: 90°
• Cell volume: 4119.3 ± 0.7 ų
• Cell temperature: 90 K
• Ambient diffraction temperature: 90 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0695
• Residual factor for significantly intense reflections: 0.0538
• Weighted residual factors for all reflections: 0.1103
• Weighted residual factors for all reflections included in the refinement: 0.0933
• Goodness-of-fit parameter for all reflections: 0.9022
• Goodness-of-fit parameter for all reflections included in the refinement: 1.0195
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes