Information card for entry 7713174

Structure parameters

• Chemical name: [MC1mim]2[Tm(NO3)5]
• Formula: C12 H22 N9 O15 Tm
• Calculated formula: C12 H22 N9 O15 Tm
• Title of publication: Low-melting Multicharge Ionic Liquids with [Ln(NO3)5]2− (Ln = Ho–Lu): Structural, Electrostatic, Thermochemical, and Fluorescence Properties
• Authors of publication: Wang, Shuang-Long; Yuan, Wen-Li; Zhao, Ying; Cheng, Kun-Lun; Tao, Guo-Hong; He, Ling
• Journal of publication: Dalton Transactions
• Year of publication: 2023
• a: 16.5968 ± 0.0004 Å
• b: 9.6698 ± 0.0003 Å
• c: 15.4989 ± 0.0004 Å
• α: 90°
• β: 91.436 ± 0.002°
• γ: 90°
• Cell volume: 2486.6 ± 0.12 ų
• Cell temperature: 289 ± 16 K
• Ambient diffraction temperature: 289 ± 16 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: I 1 2/a 1
• Hall space group symbol: -I 2ya
• Residual factor for all reflections: 0.0509
• Residual factor for significantly intense reflections: 0.0496
• Weighted residual factors for significantly intense reflections: 0.1334
• Weighted residual factors for all reflections included in the refinement: 0.1354
• Goodness-of-fit parameter for all reflections included in the refinement: 1.052
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No