Information card for entry 2022682

Structure parameters

• Chemical name: Poly[[μ~2~-1,4-bis(1<i>H</i>-imidazol-1-yl)benzene]{μ~2~-5-[(3-carboxyphenoxy)methyl]isophthalato}cadmium(II)]
• Formula: C28 H20 Cd N4 O7
• Calculated formula: C28 H20 Cd N4 O7
• Title of publication: Cd^II^-based compound as a multi-responsive fluorescent probe for sensing Fe^III^ cations and Cr^VI^ oxyanions
• Authors of publication: An, Yan-Yan; Su, Li-Jun; Zhao, Xin; Yan, Juan-Zhi
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2022
• Journal volume: 78
• Journal issue: 11
• a: 10.1105 ± 0.0006 Å
• b: 12.0603 ± 0.0006 Å
• c: 21.2013 ± 0.0012 Å
• α: 90°
• β: 103.067 ± 0.0012°
• γ: 90°
• Cell volume: 2518.3 ± 0.2 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0263
• Residual factor for significantly intense reflections: 0.0237
• Weighted residual factors for significantly intense reflections: 0.0601
• Weighted residual factors for all reflections included in the refinement: 0.0614
• Goodness-of-fit parameter for all reflections included in the refinement: 1.083
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes