Information card for entry 7044067

Structure parameters

• Formula: C25 H40 Cl4 Cu3 N10 O
• Calculated formula: C25 H40 Cl4 Cu3 N10 O
• Title of publication: Towards ionic liquids with tailored magnetic properties: bmim+ salts of ferro- and antiferromagnetic CuII3 triangles
• Authors of publication: Boudalis, Athanassios; Rogez, Guillaume; Heinrich, Benoît; Raptis, Raphael; Turek, Philippe
• Journal of publication: Dalton Trans.
• Year of publication: 2017
• a: 11.5442 ± 0.0006 Å
• b: 15.6305 ± 0.0009 Å
• c: 19.9973 ± 0.0011 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3608.3 ± 0.3 ų
• Cell temperature: 298.15 K
• Ambient diffraction temperature: 298.15 K
• Number of distinct elements: 6
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0711
• Residual factor for significantly intense reflections: 0.0451
• Weighted residual factors for significantly intense reflections: 0.0978
• Weighted residual factors for all reflections included in the refinement: 0.1107
• Goodness-of-fit parameter for all reflections included in the refinement: 1.043
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No