Information card for entry 7240570

Structure parameters

• Formula: C26 H21 Cd N6 O7.5
• Calculated formula: C26 H19.5 Cd N6 O7.5
• Title of publication: R-Substituent induced structural diversity, synergistic effect and highly selective luminescence sensing for Fe3+ detection by post-synthetically modified Cd-MOFs
• Authors of publication: Liu, Qing; Tan, Jing-Yi; Zhang, Jian-Yong; Zhang, Na; Deng, Wei
• Journal of publication: CrystEngComm
• Year of publication: 2020
• a: 23.2258 ± 0.0013 Å
• b: 13.1165 ± 0.0006 Å
• c: 27.3081 ± 0.0015 Å
• α: 90°
• β: 141.282 ± 0.003°
• γ: 90°
• Cell volume: 5203.5 ± 0.6 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0543
• Residual factor for significantly intense reflections: 0.0383
• Weighted residual factors for significantly intense reflections: 0.0749
• Weighted residual factors for all reflections included in the refinement: 0.0829
• Goodness-of-fit parameter for all reflections included in the refinement: 0.942
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No