Information card for entry 7225871

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: 9.1242 ± 0.0001 Å
• b: 13.8132 ± 0.0002 Å
• c: 9.0359 ± 0.0001 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1138.83 ± 0.02 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 5
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor R(I) for significantly intense reflections: 0.223
• Goodness-of-fit parameter for all reflections: 6.094
• Method of determination: powder diffraction
• Diffraction radiation wavelength: 0.61969 Å
• Diffraction radiation type: Synchrotron
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No