Information card for entry 2214366

Structure parameters

• Common name: [<i>N</i>,<i>N</i>'-Bis(salicylidene)benzene-1,2-diaminato]iron(II)
• Chemical name: {2,2'-[o-phenylenebis(nitrilomethylidyne)]diphenolato}iron(II)
• Formula: C20 H14 Fe N2 O2
• Calculated formula: C20 H14 Fe N2 O2
• SMILES: c12ccccc1[N]1=Cc3ccccc3O[Fe]31[N]2=Cc1c(cccc1)O3
• Title of publication: [<i>N</i>,<i>N</i>'-Bis(salicylidene)benzene-1,2-diaminato]iron(II)
• Authors of publication: Ye, Yong-Hao; Han, Yue; Chen, Ting-Ting; Liu, Chang-Hong
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 7
• Pages of publication: m1963 - m1963
• a: 5.4675 ± 0.001 Å
• b: 16.616 ± 0.004 Å
• c: 17.31 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1572.6 ± 0.5 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 5
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.076
• Residual factor for significantly intense reflections: 0.0544
• Weighted residual factors for significantly intense reflections: 0.1464
• Weighted residual factors for all reflections included in the refinement: 0.1697
• Goodness-of-fit parameter for all reflections included in the refinement: 0.689
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes