Information card for entry 2021939

Structure parameters

• Chemical name: Poly[[μ-5,5'-bis(1<i>H</i>-imidazol-1-yl)-2,2'-bithiophene-κ^2^<i>N</i>:<i>N</i>'](μ~2~-4,4'-oxydibenzoato-κ^2^<i>O</i>:<i>O</i>')copper(II)]
• Formula: C28 H18 Cu N4 O5 S2
• Calculated formula: C28 H18 Cu N4 O5 S2
• Title of publication: One-pot concomitant preparation of two copper(II) coordination polymers with different configurations of bridging bithiophene ligands
• Authors of publication: Shi, Zhi-Qiang; Ji, Ning-Ning; Hu, Hai-Liang
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2020
• Journal volume: 76
• Journal issue: 1
• Pages of publication: 37 - 43
• a: 21.086 ± 0.002 Å
• b: 8.0671 ± 0.0009 Å
• c: 15.9578 ± 0.0018 Å
• α: 90°
• β: 103.623 ± 0.002°
• γ: 90°
• Cell volume: 2638.1 ± 0.5 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 6
• 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: 0.0341
• Residual factor for significantly intense reflections: 0.0294
• Weighted residual factors for significantly intense reflections: 0.0923
• Weighted residual factors for all reflections included in the refinement: 0.0954
• Goodness-of-fit parameter for all reflections included in the refinement: 1.038
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes