Information card for entry 2208804

Structure parameters

• Chemical name: Hemi{tris(picolinic acid-κ^2^<i>N</i>,<i>O</i>)iron(II)/tris(picolinato- κ^2^<i>N</i>,<i>O</i>)iron(II)} hemi(tetrafluoroborate)
• Formula: C18 H13.5 B0.5 F2 Fe N3 O6
• Calculated formula: C18 H13.5 B0.5 F2.01 Fe N3 O6
• Title of publication: Hemi{tris(picolinic acid-κ^2^<i>N</i>,<i>O</i>)iron(II)/tris(picolinato-κ^2^<i>N</i>,<i>O</i>)iron(II)} hemi(tetrafluoroborate)
• Authors of publication: Onggo, Djulia; Martak, Fatimah; Ismunandar; Yamin, Bohari M.; Ng, Seik Weng
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2006
• Journal volume: 62
• Journal issue: 5
• Pages of publication: m1112 - m1113
• a: 13.564 ± 0.002 Å
• b: 13.564 Å
• c: 6.0108 ± 0.0009 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 957.7 ± 0.2 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 2 K
• Number of distinct elements: 7
• Space group number: 147
• Hermann-Mauguin space group symbol: P -3
• Hall space group symbol: -P 3
• Residual factor for all reflections: 0.071
• Residual factor for significantly intense reflections: 0.065
• Weighted residual factors for significantly intense reflections: 0.151
• Weighted residual factors for all reflections included in the refinement: 0.154
• Goodness-of-fit parameter for all reflections included in the refinement: 1.21
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes