Information card for entry 7222046

Structure parameters

• Formula: C38 H27 Cd2 N5 O9
• Calculated formula: C38 H27 Cd2 N5 O9
• 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: 12.0855 ± 0.0006 Å
• b: 12.1636 ± 0.0006 Å
• c: 13.5127 ± 0.0006 Å
• α: 98.04 ± 0.004°
• β: 111.284 ± 0.004°
• γ: 96.639 ± 0.004°
• Cell volume: 1802.68 ± 0.16 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0432
• Residual factor for significantly intense reflections: 0.0333
• Weighted residual factors for significantly intense reflections: 0.0771
• Weighted residual factors for all reflections included in the refinement: 0.0873
• Goodness-of-fit parameter for all reflections included in the refinement: 1.091
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No