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Information card for entry 7134767
Preview
| Coordinates | 7134767.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C22 H17 Br N O3 |
|---|---|
| Calculated formula | C22 H17 Br N O3 |
| Title of publication | Cycloaddition of Bicyclo [1.1.0] butanes with Enamides for the Efficient Synthesis of 2-amino-bicyclo[2.1.1]hexanes |
| Authors of publication | Zhu, Yanren; Yang, Shaoxiong; Chen, Huiyu; Zhang, Fang; Pu, Enfan; Jiang, Piaopiao; Jin, Yi; Zhang, Hongbin; Chen, Jingbo |
| Journal of publication | Chemical Communications |
| Year of publication | 2025 |
| a | 7.4907 ± 0.0003 Å |
| b | 15.9278 ± 0.0007 Å |
| c | 7.9606 ± 0.0005 Å |
| α | 90° |
| β | 101.271 ± 0.002° |
| γ | 90° |
| Cell volume | 931.46 ± 0.08 Å3 |
| Cell temperature | 100 K |
| Ambient diffraction temperature | 100.15 K |
| Number of distinct elements | 5 |
| Space group number | 4 |
| Hermann-Mauguin space group symbol | P 1 21 1 |
| Hall space group symbol | P 2yb |
| Residual factor for all reflections | 0.0422 |
| Residual factor for significantly intense reflections | 0.0382 |
| Weighted residual factors for significantly intense reflections | 0.0926 |
| Weighted residual factors for all reflections included in the refinement | 0.0948 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.11 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 300187 (current) | 2025-06-26 | cif/ Adding structures of 7134766, 7134767 via cif-deposit CGI script. |
7134767.cif |
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Users of the data should acknowledge the original authors of the
structural data.