Information card for entry 7062039

Structure parameters

• Formula: C31 H22 F18 Gd N4 O8
• Calculated formula: C31 H22 F18 Gd N4 O8
• Title of publication: Slow magnetic relaxation and selective luminescence sensor of Ln-radical chain involving imidazole-substituted nitronyl nitroxide radical
• Authors of publication: Zhong, Qing; Dong, Huiyang; Liu, Yi; Zhu, Mei
• Journal of publication: New Journal of Chemistry
• Year of publication: 2022
• Journal volume: 46
• Journal issue: 46
• Pages of publication: 22451 - 22458
• a: 14.4274 ± 0.0006 Å
• b: 17.0891 ± 0.0008 Å
• c: 16.3608 ± 0.0007 Å
• α: 90°
• β: 102.619 ± 0.003°
• γ: 90°
• Cell volume: 3936.3 ± 0.3 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0893
• Residual factor for significantly intense reflections: 0.0768
• Weighted residual factors for significantly intense reflections: 0.2137
• Weighted residual factors for all reflections included in the refinement: 0.2283
• Goodness-of-fit parameter for all reflections included in the refinement: 1.046
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No