Information card for entry 1546845

Structure parameters

• Formula: C28 H22 N4 Ni3 O16
• Calculated formula: C28 H22 N4 Ni3 O16
• Title of publication: Four coordination polymers based on dinuclear and trinuclear units with a new multifunctional pyridyl-dicarboxylate ligand: luminescence and magnetic properties
• Authors of publication: Liu, Feng; Gao, Wei; Zhang, Xiu-Mei; Liu, Jie-Ping; Gao, En-Qing
• Journal of publication: CrystEngComm
• Year of publication: 2017
• Journal volume: 19
• Journal issue: 38
• Pages of publication: 5755 - 5763
• a: 8.0042 ± 0.0002 Å
• b: 11.5133 ± 0.0003 Å
• c: 17.4969 ± 0.0005 Å
• α: 90°
• β: 114.231 ± 0.001°
• γ: 90°
• Cell volume: 1470.37 ± 0.07 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 13
• Hermann-Mauguin space group symbol: P 1 2/c 1
• Hall space group symbol: -P 2yc
• Residual factor for all reflections: 0.0432
• Residual factor for significantly intense reflections: 0.0336
• Weighted residual factors for significantly intense reflections: 0.0797
• Weighted residual factors for all reflections included in the refinement: 0.0843
• 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: No
• Has Fobs: No