Information card for entry 7235136

Structure parameters

• Formula: C17 H19 Cd N5 O5 S
• Calculated formula: C17 H19 Cd N5 O5 S
• Title of publication: A novel photoluminescent Cd(ii)-organic framework exhibiting rapid and efficient multi-responsive fluorescence sensing for trace amounts of Fe3+ ions and some NACs, especially for 4-nitroaniline and 2-methyl-4-nitroaniline
• Authors of publication: Ying-Jiao Yang; Meng-Jie Wang; Kou-Lin Zhang
• Journal of publication: Journal of Materials Chemistry C
• Year of publication: 2016
• Journal volume: 4
• Pages of publication: 11404 - 11418
• a: 8.6563 ± 0.0009 Å
• b: 9.064 ± 0.0009 Å
• c: 13.2673 ± 0.0013 Å
• α: 106.62 ± 0.001°
• β: 92.775 ± 0.001°
• γ: 100.439 ± 0.001°
• Cell volume: 975.4 ± 0.17 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 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: 0.039
• Residual factor for significantly intense reflections: 0.0383
• Weighted residual factors for significantly intense reflections: 0.1043
• Weighted residual factors for all reflections included in the refinement: 0.105
• Goodness-of-fit parameter for all reflections included in the refinement: 1.075
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No