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Information card for entry 7132146
Preview
| Coordinates | 7132146.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C31 H24 B F2 N3 |
|---|---|
| Calculated formula | C31 H24 B F2 N3 |
| Title of publication | Pictet–Spengler Synthesis of Twist Quinoline-Fused BODIPYs as Heavy-Atom-Free Photosensitizers |
| Authors of publication | Li, Wanwan; Gong, Qingbao; Wu, Qinghua; Guo, Luying; Guo, Xing; Guo, Dianjun; Jiao, Lijuan; Hao, Erhong |
| Journal of publication | Chemical Communications |
| Year of publication | 2023 |
| a | 12.3821 ± 0.0012 Å |
| b | 18.3455 ± 0.0015 Å |
| c | 11.4591 ± 0.0012 Å |
| α | 90° |
| β | 110.66 ± 0.003° |
| γ | 90° |
| Cell volume | 2435.6 ± 0.4 Å3 |
| Cell temperature | 300 K |
| Ambient diffraction temperature | 300 K |
| Number of distinct elements | 5 |
| 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 | 0.0841 |
| Residual factor for significantly intense reflections | 0.0626 |
| Weighted residual factors for significantly intense reflections | 0.1601 |
| Weighted residual factors for all reflections included in the refinement | 0.1786 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.026 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 286469 (current) | 2023-09-23 | cif/ Adding structures of 7132146, 7132147 via cif-deposit CGI script. |
7132146.cif |
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Users of the data should acknowledge the original authors of the
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