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Information card for entry 7719458
Preview
| Coordinates | 7719458.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C45 H37 Ba2 Cl N20 O26 |
|---|---|
| Calculated formula | C45 H37 Ba2 Cl N20 O26 |
| Title of publication | Carboxylate ligands-directed synthesis of cucurbit[5]uril-based coordination polymers for the detection of norfloxacin |
| Authors of publication | Cao, Jia; Gu, JiaYu; Ding, Wen-Ya; Chen, Wen-Ya; Hua, Zi-Yi; Chen, Kai |
| Journal of publication | Dalton Transactions |
| Year of publication | 2025 |
| a | 14.666 ± 0.005 Å |
| b | 20.87 ± 0.005 Å |
| c | 19.989 ± 0.005 Å |
| α | 90 ± 0.005° |
| β | 109.804 ± 0.005° |
| γ | 90 ± 0.005° |
| Cell volume | 5756 ± 3 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 6 |
| 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 | 0.0555 |
| Residual factor for significantly intense reflections | 0.0459 |
| Weighted residual factors for significantly intense reflections | 0.1516 |
| Weighted residual factors for all reflections included in the refinement | 0.1577 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.058 |
| Diffraction radiation wavelength | 0.71069 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 302129 (current) | 2025-09-13 | cif/ Adding structures of 7719458, 7719459, 7719460 via cif-deposit CGI script. |
7719458.cif |
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