Information card for entry 2226680

Structure parameters

• Chemical name: <i>fac</i>-Tris(4-aminobenzohydroxamato)iron(III) ethanol solvate
• Formula: C23 H27 Fe N6 O7
• Calculated formula: C23 H27 Fe N6 O7
• Title of publication: <i>fac</i>-Tris(4-aminobenzohydroxamato)iron(III) ethanol solvate
• Authors of publication: Alagha, Ahmed B. M.; Gaynor, Declan; Müller-Bunz, Helge; Nolan, Kevin B.; Parthasarathi, Laavanya
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2010
• Journal volume: 66
• Journal issue: 7
• Pages of publication: m853 - m854
• a: 10.6232 ± 0.0018 Å
• b: 10.6455 ± 0.0018 Å
• c: 13.225 ± 0.002 Å
• α: 107.55 ± 0.003°
• β: 91.085 ± 0.004°
• γ: 112.217 ± 0.003°
• Cell volume: 1305.1 ± 0.4 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0473
• Residual factor for significantly intense reflections: 0.0396
• Weighted residual factors for significantly intense reflections: 0.0905
• Weighted residual factors for all reflections included in the refinement: 0.094
• Goodness-of-fit parameter for all reflections included in the refinement: 1.061
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes