Information card for entry 1564111

Structure parameters

• Formula: C42 H52 Cd N18 O10
• Calculated formula: C42 H52 Cd N18 O10
• Title of publication: Assembly of a Cd(II)-organic framework based on 1,3,5-Tri(1H-imidazol-1-yl)benzene: Synthesis, crystal structure, and luminescent sensing property
• Authors of publication: Liu, Daofu; Zhu, Qiyong; Wen, Guilin; Zhou, Weiwei; Wang, Xiaoling; Liang, Xian; Rong, Jiewei; Shao, Jiantao
• Journal of publication: Inorganica Chimica Acta
• Year of publication: 2020
• Journal volume: 512
• Pages of publication: 119891
• a: 11.6372 ± 0.0011 Å
• b: 17.92 ± 0.0015 Å
• c: 13.9861 ± 0.0013 Å
• α: 90°
• β: 123.001 ± 0.006°
• γ: 90°
• Cell volume: 2446.1 ± 0.4 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296.15 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0724
• Residual factor for significantly intense reflections: 0.043
• Weighted residual factors for significantly intense reflections: 0.0946
• Weighted residual factors for all reflections included in the refinement: 0.1069
• Goodness-of-fit parameter for all reflections included in the refinement: 1.026
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No