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Information card for entry 7160540
Preview
| Coordinates | 7160540.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C31 H37 Cl6 N3 O6 |
|---|---|
| Calculated formula | C31 H37 Cl6 N3 O6 |
| Title of publication | Synthesis of 3-indolyl all-carbon quaternary centers via Rh/Brønsted acid co-catalyzed three-component reactions of azoalkenes with indoles and diazoacetates |
| Authors of publication | Yue, Xiao-Jing; Pei, Li-Ping; Wang, Mincan; Jia, Shi-Kun; Mei, Guang-Jian |
| Journal of publication | Organic & Biomolecular Chemistry |
| Year of publication | 2025 |
| a | 12.7618 ± 0.0005 Å |
| b | 13.0621 ± 0.0006 Å |
| c | 13.4282 ± 0.0007 Å |
| α | 113.796 ± 0.005° |
| β | 90.707 ± 0.004° |
| γ | 110.206 ± 0.004° |
| Cell volume | 1891.85 ± 0.19 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0884 |
| Residual factor for significantly intense reflections | 0.0728 |
| Weighted residual factors for significantly intense reflections | 0.2098 |
| Weighted residual factors for all reflections included in the refinement | 0.2288 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.076 |
| 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 |
|---|---|---|---|
| 299590 (current) | 2025-05-09 | cif/ Adding structures of 7160539, 7160540 via cif-deposit CGI script. |
7160540.cif |
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Users of the data should acknowledge the original authors of the
structural data.