Information card for entry 8103231

Structure parameters

• Formula: C110 H90 Cl10 Fe4 O10 P6
• Calculated formula: C110 H90 Cl10 Fe4 O10 P6
• Title of publication: Crystal structure of (?-oxalato)bis[chlorotris(triphenylphosphine oxide-O)iron(III)] tetrachloroferrate(III), [FeCl(C18H15PO)3][C2O4][FeCl4]
• Authors of publication: Zhi-Fang Zhang
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2011
• Journal volume: 226
• Journal issue: 4
• Pages of publication: 486
• a: 10.672 ± 0.007 Å
• b: 15.74 ± 0.01 Å
• c: 16.709 ± 0.01 Å
• α: 78.803 ± 0.008°
• β: 85.771 ± 0.009°
• γ: 81.857 ± 0.009°
• Cell volume: 2722 ± 3 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 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: 0.0957
• Residual factor for significantly intense reflections: 0.0546
• Weighted residual factors for significantly intense reflections: 0.1245
• Weighted residual factors for all reflections included in the refinement: 0.1479
• Goodness-of-fit parameter for all reflections included in the refinement: 1.026
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No