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Information card for entry 1572689
Preview
| Coordinates | 1572689.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C28 H29 B N2 O2 |
|---|---|
| Calculated formula | C28 H29 B N2 O2 |
| Title of publication | Compact device prototype for turn-on fluorescence detection of sarin based on reactive 4,4-diaryloxy-BODIPY derivatives |
| Authors of publication | Liu, Lu; Li, Sheng; Luo, Wendan; Yao, Jiashuang; Liu, Taihong; Qin, Molin; Huang, Zhiyan; Ding, Liping; Fang, Yu |
| Journal of publication | Sensors & Diagnostics |
| Year of publication | 2024 |
| a | 7.7983 ± 0.0004 Å |
| b | 11.6527 ± 0.0007 Å |
| c | 13.2826 ± 0.0008 Å |
| α | 77.243 ± 0.003° |
| β | 87.408 ± 0.002° |
| γ | 86.971 ± 0.002° |
| Cell volume | 1174.87 ± 0.12 Å3 |
| Cell temperature | 268 K |
| Ambient diffraction temperature | 268 K |
| Number of distinct elements | 5 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0627 |
| Residual factor for significantly intense reflections | 0.0456 |
| Weighted residual factors for significantly intense reflections | 0.1233 |
| Weighted residual factors for all reflections included in the refinement | 0.1412 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.069 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 294879 (current) | 2024-09-25 | cif/ Adding structures of 1572689 via cif-deposit CGI script. |
1572689.cif |
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Users of the data should acknowledge the original authors of the
structural data.