Information card for entry 4333725

Structure parameters

• Formula: C40 H26 Fe2 N20 O14 Pr2
• Calculated formula: C40 H22 Fe2 N20 O14 Pr2
• Title of publication: Low-Dimensional 3d-4f Complexes Assembled by Low-Spin [FeIII(phen)(CN)4]- Anions
• Authors of publication: Diana Visinescu; Luminita Marilena Toma; Oscar Fabelo; Catalina Ruiz-Pérez; Francesc Lloret; Miguel Julve
• Journal of publication: Inorganic Chemistry
• Year of publication: 2013
• Journal volume: 52
• Pages of publication: 1525 - 1537
• a: 9.627 ± 0.0009 Å
• b: 26.323 ± 0.002 Å
• c: 10.726 ± 0.0009 Å
• α: 90 ± 0.006°
• β: 113.844 ± 0.006°
• γ: 90 ± 0.007°
• Cell volume: 2486.1 ± 0.4 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• 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: 0.0674
• Residual factor for significantly intense reflections: 0.0458
• Weighted residual factors for significantly intense reflections: 0.0684
• Weighted residual factors for all reflections included in the refinement: 0.073
• Goodness-of-fit parameter for all reflections included in the refinement: 1.151
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No