Information card for entry 7222043

Structure parameters

• Formula: C32 H23 Cd2 N13 O6
• Calculated formula: C32 H23 Cd2 N13 O6
• Title of publication: A series of mixed-ligand 2D and 3D coordination polymers assembled from a novel multifunctional pyridine-tricarboxylate building block: hydrothermal syntheses, structural and topological diversity, and magnetic and luminescent properties
• Authors of publication: Gu, Jinzhong; Cui, Yanhui; Wu, Jiang; Kirillov, Alexander M.
• Journal of publication: RSC Adv.
• Year of publication: 2015
• a: 29.1344 ± 0.0011 Å
• b: 8.6686 ± 0.0003 Å
• c: 31.9584 ± 0.0014 Å
• α: 90°
• β: 112.448 ± 0.005°
• γ: 90°
• Cell volume: 7459.7 ± 0.6 ų
• Cell temperature: 294 ± 2 K
• Ambient diffraction temperature: 294 ± 2 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: I 1 2/a 1
• Hall space group symbol: -I 2ya
• Residual factor for all reflections: 0.0715
• Residual factor for significantly intense reflections: 0.0541
• Weighted residual factors for significantly intense reflections: 0.1538
• Weighted residual factors for all reflections included in the refinement: 0.1725
• Goodness-of-fit parameter for all reflections included in the refinement: 1.036
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No