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Information card for entry 1559091
Preview
| Coordinates | 1559091.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C30 H31 Cl4 N O4 S |
|---|---|
| Calculated formula | C30 H31 Cl4 N O4 S |
| Title of publication | A near-infrared fluorescent probe for ratiometric sensing of SO2 in cells and zebrafish |
| Authors of publication | Lv, Mengya; Zhang, Yanhao; Fan, Jiayi; Yang, Yanyun; Chen, Sheng; Liang, Gaolin; Zhang, Shusheng |
| Journal of publication | The Analyst |
| Year of publication | 2020 |
| a | 7.68126 ± 0.00019 Å |
| b | 22.6995 ± 0.0005 Å |
| c | 17.94 ± 0.0003 Å |
| α | 90° |
| β | 95.2798 ± 0.0019° |
| γ | 90° |
| Cell volume | 3114.76 ± 0.12 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/c 1 |
| Hall space group symbol | -P 2ybc |
| Residual factor for all reflections | 0.0839 |
| Residual factor for significantly intense reflections | 0.0683 |
| Weighted residual factors for significantly intense reflections | 0.197 |
| Weighted residual factors for all reflections included in the refinement | 0.2148 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.05 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 1.54184 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 256436 (current) | 2020-09-16 | cif/ Adding structures of 1559091 via cif-deposit CGI script. |
1559091.cif |
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Users of the data should acknowledge the original authors of the
structural data.