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Information card for entry 7158101
Preview
| Coordinates | 7158101.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C20 H15 B F2 N4 S |
|---|---|
| Calculated formula | C20 H15 B F2 N4 S |
| Title of publication | Boron complexes of thiazole-bridged 1,5-bidentate nitrogen ligands: synthesis and acid-responsive photophysical properties |
| Authors of publication | Puji Pamungkas, Khurnia Krisna; Maruyama, Toshifumi; Murai, Toshiaki |
| Journal of publication | Organic & Biomolecular Chemistry |
| Year of publication | 2021 |
| a | 7.9896 ± 0.0002 Å |
| b | 9.2646 ± 0.0003 Å |
| c | 13.4601 ± 0.0004 Å |
| α | 105.166 ± 0.003° |
| β | 96.037 ± 0.002° |
| γ | 108.811 ± 0.003° |
| Cell volume | 890.46 ± 0.05 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0644 |
| Residual factor for significantly intense reflections | 0.0421 |
| Weighted residual factors for significantly intense reflections | 0.1007 |
| Weighted residual factors for all reflections included in the refinement | 0.1153 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.042 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 265576 (current) | 2021-05-28 | cif/ Adding structures of 7158101 via cif-deposit CGI script. |
7158101.cif |
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Users of the data should acknowledge the original authors of the
structural data.