Information card for entry 2203921

Structure parameters

• Chemical name: Azido[bis(2-oxidophenylmethyleneimino)propane-1,2-diamine(2-)]iron(III)
• Formula: C17 H16 Fe N5 O2
• Calculated formula: C17 H16 Fe N5 O2
• Title of publication: Azido[bis(2-oxidophenylmethyleneimino)propane-1,2-diamine(2–)]iron(III)
• Authors of publication: Liu, Zhao-Di; Tan, Min-Yu; Zhu, Hai-Liang
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2004
• Journal volume: 60
• Journal issue: 7
• Pages of publication: m910 - m911
• a: 8.7388 ± 0.0008 Å
• b: 13.7957 ± 0.0013 Å
• c: 14.4499 ± 0.0014 Å
• α: 90°
• β: 105.62 ± 0.002°
• γ: 90°
• Cell volume: 1677.7 ± 0.3 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 5
• 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: 0.1136
• Residual factor for significantly intense reflections: 0.0718
• Weighted residual factors for significantly intense reflections: 0.1996
• Weighted residual factors for all reflections included in the refinement: 0.2253
• 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