Information card for entry 4336624

Structure parameters

• Formula: C39 H21 Ce N O8
• Calculated formula: C39 H21 Ce N O8
• Title of publication: Gas Sorption, Second-Order Nonlinear Optics, and Luminescence Properties of a Series of Lanthanide-Organic Frameworks Based on Nanosized Tris((4-carboxyl)phenylduryl)amine Ligand
• Authors of publication: Yan-Ping He; Yan-Xi Tan; Jian Zhang
• Journal of publication: Inorganic Chemistry
• Year of publication: 2013
• Journal volume: 52
• Pages of publication: 12758 - 12762
• a: 22.1408 ± 0.0006 Å
• b: 24.5577 ± 0.0008 Å
• c: 7.3445 ± 0.0002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3993.4 ± 0.2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 30
• Hermann-Mauguin space group symbol: P n c 2
• Hall space group symbol: P 2 -2bc
• Residual factor for all reflections: 0.0722
• Residual factor for significantly intense reflections: 0.0663
• Weighted residual factors for significantly intense reflections: 0.1748
• Weighted residual factors for all reflections included in the refinement: 0.1793
• Goodness-of-fit parameter for all reflections included in the refinement: 1.108
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No