Information card for entry 2014168

Structure parameters

• Chemical name: diaquabis(ethylenediamine-κ^2^N,N')copper(II)hexacyanoiron(II) tetrahydrate
• Formula: C14 H47.74 Cu2 Fe N14 O7.86
• Calculated formula: C14 H44.322 Cu2 Fe N14 O7.86
• Title of publication: Hydrate isomerism in [Cu(en)~2~(H~2~O)~1.935~]~2~[Fe(CN)~6~]·4H~2~O
• Authors of publication: Kuchár, Juraj; Černák, Juraj; Massa, Werner
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2004
• Journal volume: 60
• Journal issue: 8
• Pages of publication: m418 - m420
• a: 7.9407 ± 0.0006 Å
• b: 8.9815 ± 0.0007 Å
• c: 10.9523 ± 0.001 Å
• α: 91.072 ± 0.01°
• β: 91.061 ± 0.01°
• γ: 101.29 ± 0.009°
• Cell volume: 765.67 ± 0.11 ų
• Cell temperature: 193 ± 1 K
• Ambient diffraction temperature: 193 ± 1 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0344
• Residual factor for significantly intense reflections: 0.0286
• Weighted residual factors for significantly intense reflections: 0.0707
• Weighted residual factors for all reflections included in the refinement: 0.0729
• Goodness-of-fit parameter for all reflections included in the refinement: 0.992
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes