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Information card for entry 7241294
Preview
| Coordinates | 7241294.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C96 H72 Cd N24 O20 |
|---|---|
| Calculated formula | C96 H72 Cd N24 O20 |
| Title of publication | A cucurbit[6]uril-based supramolecular assembly test strip for immediate detection of nitrofuran antibiotics in water |
| Authors of publication | Liu, Mei; Shi, Lulu; Fang, Cao; Zhu, Xiaofei; Li, Hui |
| Journal of publication | CrystEngComm |
| Year of publication | 2020 |
| a | 17.9377 ± 0.0011 Å |
| b | 21.9449 ± 0.0014 Å |
| c | 25.6202 ± 0.0016 Å |
| α | 90° |
| β | 106.696 ± 0.002° |
| γ | 90° |
| Cell volume | 9660 ± 1.1 Å3 |
| Cell temperature | 273 ± 2 K |
| Ambient diffraction temperature | 273.15 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 | 0.0388 |
| Residual factor for significantly intense reflections | 0.0354 |
| Weighted residual factors for significantly intense reflections | 0.0855 |
| Weighted residual factors for all reflections included in the refinement | 0.0915 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.112 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 256694 (current) | 2020-09-24 | cif/ Adding structures of 7241294 via cif-deposit CGI script. |
7241294.cif |
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Users of the data should acknowledge the original authors of the
structural data.