Information card for entry 7225872

Structure parameters

• Common name: DimimFeCl4 (dimim=1,3-dimethylimidazolium)
• Formula: C5 H9 Cl4 Fe N2
• Calculated formula: C5 H9 Cl4 Fe N2
• SMILES: [Fe](Cl)(Cl)(Cl)[Cl-].n1(c[n+](cc1)C)C
• Title of publication: Dynamically Slow Solid-to-Solid Phase Transition Induced by Thermal Treatment on DimimFeCl4 Magnetic Ionic Liquid
• Authors of publication: de Pedro, Imanol; Fabelo, Oscar; Garcia Saiz, Abel; Vallcorba, Oriol; Junquera, Javier; Blanco, Jesus A.; Waerenborgh, João C.; Andreica, Daniel; Wildes, Andrew; Fernandez-Diaz, Maria Teresa; Rogriguez, Jesus
• Journal of publication: Phys. Chem. Chem. Phys.
• Year of publication: 2016
• a: 14.1391 ± 0.0003 Å
• b: 13.7039 ± 0.0003 Å
• c: 13.2935 ± 0.0003 Å
• α: 90°
• β: 115.539 ± 0.002°
• γ: 90°
• Cell volume: 2324.09 ± 0.1 ų
• Cell temperature: 220 K
• Ambient diffraction temperature: 220 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor R(I) for significantly intense reflections: 0.025
• Goodness-of-fit parameter for all reflections: 8.593
• Method of determination: powder diffraction
• Diffraction radiation wavelength: 0.61969 Å
• Diffraction radiation type: Synchrotron
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No