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Information card for entry 1577392
Preview
| Coordinates | 1577392.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C28 H27 B O |
|---|---|
| Calculated formula | C28 H27 B O |
| Title of publication | Photo-Induced Terminal Alkyne Insertion into Arene Ring to Synthesize Boron-Doped Polycycles |
| Authors of publication | Li, Hai-Jun; Xi, Biying; Jing, Hui-Xian; Li, Xin; Jia, Hongnan; Fan, Manman; Zhu, Weiguo; Feng, Rui; Hao, Baorui; Li, Shi-Jun; Yu, Bing; Lan, Yu; Du, Jingzhen |
| Journal of publication | Chemical Science |
| Year of publication | 2026 |
| a | 8.233 ± 0.0005 Å |
| b | 11.8475 ± 0.0008 Å |
| c | 11.8841 ± 0.0008 Å |
| α | 91.103 ± 0.002° |
| β | 101.962 ± 0.002° |
| γ | 98.061 ± 0.002° |
| Cell volume | 1121.41 ± 0.13 Å3 |
| Cell temperature | 293 ± 0.1 K |
| Ambient diffraction temperature | 293 ± 0.1 K |
| Number of distinct elements | 4 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0829 |
| Residual factor for significantly intense reflections | 0.0601 |
| Weighted residual factors for significantly intense reflections | 0.1636 |
| Weighted residual factors for all reflections included in the refinement | 0.1936 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.023 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 306559 (current) | 2026-06-12 | cif/ Adding structures of 1577391, 1577392, 1577393, 1577394, 1577395, 1577396, 1577397, 1577398 via cif-deposit CGI script. |
1577392.cif |
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Users of the data should acknowledge the original authors of the
structural data.