Information card for entry 4341064

Structure parameters

• Formula: C54 H51 Gd2 N9 O15
• Calculated formula: C54 H51 Gd2 N9 O15
• Title of publication: Lanthanide Coordination Polymers with "fsy-type" Topology Based on 4,4'-Azobenzoic Acid: Syntheses, Crystal Structures, and Magnetic Properties.
• Authors of publication: Zhang, Shaowei; Shi, Wei; Li, Leilei; Duan, Eryue; Cheng, Peng
• Journal of publication: Inorganic chemistry
• Year of publication: 2014
• Journal volume: 53
• Journal issue: 19
• Pages of publication: 10340 - 10346
• a: 16.2318 ± 0.0005 Å
• b: 8.7252 ± 0.0003 Å
• c: 20.7773 ± 0.0006 Å
• α: 90°
• β: 94.984 ± 0.003°
• γ: 90°
• Cell volume: 2931.47 ± 0.16 ų
• Cell temperature: 126.95 ± 0.1 K
• Ambient diffraction temperature: 126.95 ± 0.1 K
• Number of distinct elements: 5
• 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: 0.0477
• Residual factor for significantly intense reflections: 0.0399
• Weighted residual factors for significantly intense reflections: 0.0887
• Weighted residual factors for all reflections included in the refinement: 0.0933
• Goodness-of-fit parameter for all reflections included in the refinement: 1.051
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No