Information card for entry 7056281

Structure parameters

• Formula: C8 H8 N3 O6 Sm
• Calculated formula: C8 H8 N3 O6 Sm
• Title of publication: Two 3D nonlinear optical and luminescent Lanthanide-organic frameworks with multidirectional helical intersecting channels
• Authors of publication: Sun, Yan-Qiong; Liu, Qi; Liu, Le-Hui; Ding, Ling; Chen, Yi-Ping
• Journal of publication: New J. Chem.
• Year of publication: 2017
• a: 10.243 ± 0.002 Å
• b: 10.371 ± 0.002 Å
• c: 11.131 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1182.4 ± 0.4 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 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 for all reflections: 0.0131
• Residual factor for significantly intense reflections: 0.0129
• Weighted residual factors for significantly intense reflections: 0.0289
• Weighted residual factors for all reflections included in the refinement: 0.029
• Goodness-of-fit parameter for all reflections included in the refinement: 1.14
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No