Information card for entry 7227074

Structure parameters

• Formula: C37 H22 Br Cu F30 La N3 O13
• Calculated formula: C37 H22 Br Cu F30 La N3 O13
• Title of publication: Cu‒Ln compounds based on nitronyl nitroxide radicals: synthesis, structure, and magnetic and fluorescence properties
• Authors of publication: Yang, Meng; Sun, Juan; Guo, Jianni; Sun, Guifang; Li, Licun
• Journal of publication: CrystEngComm
• Year of publication: 2016
• Journal volume: 18
• Journal issue: 48
• Pages of publication: 9345
• a: 14.835 ± 0.003 Å
• b: 19.359 ± 0.004 Å
• c: 18.279 ± 0.004 Å
• α: 90°
• β: 100.87 ± 0.03°
• γ: 90°
• Cell volume: 5155.4 ± 1.9 ų
• Cell temperature: 113 ± 2 K
• Ambient diffraction temperature: 113 ± 2 K
• Number of distinct elements: 8
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0654
• Residual factor for significantly intense reflections: 0.0485
• Weighted residual factors for significantly intense reflections: 0.1237
• Weighted residual factors for all reflections included in the refinement: 0.137
• Goodness-of-fit parameter for all reflections included in the refinement: 1.005
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No