Information card for entry 2018177

Structure parameters

• Chemical name: bis(acetonitrile-κ<i>N</i>)bis[<i>N</i>,<i>N</i>- bis(diphenylphosphanyl)ethanamine-κ^2^<i>P</i>,<i>P</i>']iron(II) μ-oxido-bis[tribromidoferrate(III)]
• Formula: C56 H56 Br6 Fe3 N4 O P4
• Calculated formula: C56 H56 Br6 Fe3 N4 O P4
• Title of publication: The bis(acetonitrile-κ<i>N</i>)bis[<i>N</i>,<i>N</i>-bis(diphenylphosphanyl)ethanamine-κ^2^<i>P</i>,<i>P</i>']iron(II) tetrabromidoferrate(II) and μ-oxido-bis[tribromidoferrate(III)] complex salts
• Authors of publication: Maithufi, Norah; Otto, Stefanus
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2011
• Journal volume: 67
• Journal issue: 8
• Pages of publication: m279 - m283
• a: 18.928 ± 0.005 Å
• b: 18.352 ± 0.004 Å
• c: 17.243 ± 0.004 Å
• α: 90°
• β: 90.365 ± 0.003°
• γ: 90°
• Cell volume: 5990 ± 2 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0524
• Residual factor for significantly intense reflections: 0.0386
• Weighted residual factors for significantly intense reflections: 0.091
• Weighted residual factors for all reflections included in the refinement: 0.0966
• Goodness-of-fit parameter for all reflections included in the refinement: 1.036
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes