Information card for entry 7058115

Structure parameters

• Chemical name: 1,3-dimethylimidazolium (?-oxido)bis[trichloridoferrate(III)]
• Formula: C10 H18 Cl6 Fe2 N4 O
• Calculated formula: C10 H18 Cl6 Fe2 N4 O
• Title of publication: Comparing conventional and microwave-assisted heating in PET degradation mediated by imidazolium-based halometallate complexes
• Authors of publication: Scé, Fabio; Cano, Israel; Martin, Carmen; Beobide, Garikoitz; Castillo, Óscar; de Pedro, Imanol
• Journal of publication: New Journal of Chemistry
• Year of publication: 2019
• Journal volume: 43
• Journal issue: 8
• Pages of publication: 3476
• a: 7.3221 ± 0.0011 Å
• b: 7.5071 ± 0.0008 Å
• c: 10.4916 ± 0.0012 Å
• α: 102.996 ± 0.01°
• β: 100.472 ± 0.011°
• γ: 92.433 ± 0.011°
• Cell volume: 550.47 ± 0.12 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.097
• Residual factor for significantly intense reflections: 0.0865
• Weighted residual factors for significantly intense reflections: 0.2617
• Weighted residual factors for all reflections included in the refinement: 0.2806
• Goodness-of-fit parameter for all reflections included in the refinement: 1.088
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No