Information card for entry 7245479

Structure parameters

• Formula: C24 H17 Cd N3 O5
• Calculated formula: C24 H17 Cd N3 O5
• Title of publication: Syntheses, structures, and luminescence properties of five new coordination polymers based on 3-carboxy-1-(3′-carboxybenzyl)-2-oxidopyridinium and neutral ligands
• Authors of publication: He, Yuan-Chun; Wu, Shuang; Zhang, Jie; Qin, Wen-Hui; Liu, Jing; Zhao, Fang-Hua; Liu, Lin; Jing, Zhihong
• Journal of publication: CrystEngComm
• Year of publication: 2022
• a: 10.0832 ± 0.0003 Å
• b: 10.6327 ± 0.0004 Å
• c: 11.3485 ± 0.0003 Å
• α: 93.508 ± 0.001°
• β: 106.005 ± 0.001°
• γ: 113.333 ± 0.001°
• Cell volume: 1053.68 ± 0.06 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: 0.0216
• Residual factor for significantly intense reflections: 0.0196
• Weighted residual factors for significantly intense reflections: 0.0512
• Weighted residual factors for all reflections included in the refinement: 0.0523
• Goodness-of-fit parameter for all reflections included in the refinement: 1.105
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No