Information card for entry 7228854

Structure parameters

• Formula: C78 H60 Cd2 N8 O17 P2
• Calculated formula: C78 H60 Cd2 N8 O17 P2
• Title of publication: Two Cadmium Coordination Polymers Based on Tris(p-carboxyphenyl) phosphane Oxide with Highly Selective Sensing of Nitrobenzene Derivatives and Hg2+ Cation
• Authors of publication: Huo, Liangqin; Zhang, Jie; Gao, Lingling; Wang, Xiaoqing; Liming, Fan; Fang, Kegong; Hu, Tuoping
• Journal of publication: CrystEngComm
• Year of publication: 2017
• a: 9.9742 ± 0.0012 Å
• b: 13.766 ± 0.0016 Å
• c: 26.363 ± 0.003 Å
• α: 94.356 ± 0.003°
• β: 92.135 ± 0.003°
• γ: 93.846 ± 0.003°
• Cell volume: 3597.9 ± 0.7 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0883
• Residual factor for significantly intense reflections: 0.0579
• Weighted residual factors for significantly intense reflections: 0.1465
• Weighted residual factors for all reflections included in the refinement: 0.1652
• Goodness-of-fit parameter for all reflections included in the refinement: 1.058
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No