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Information card for entry 7159928
Preview
| Coordinates | 7159928.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C16 H22 I N O2 |
|---|---|
| Calculated formula | C16 H22 I N O2 |
| Title of publication | Borrowing hydrogen <i>C</i>-alkylation with secondary saturated heterocyclic alcohols. |
| Authors of publication | François, Jordan; Jacolot, Maïwenn; Popowycz, Florence |
| Journal of publication | Organic & biomolecular chemistry |
| Year of publication | 2024 |
| Journal volume | 22 |
| Journal issue | 22 |
| Pages of publication | 4502 - 4507 |
| a | 9.6026 ± 0.0003 Å |
| b | 10.9032 ± 0.0003 Å |
| c | 15.9038 ± 0.0005 Å |
| α | 80.907 ± 0.003° |
| β | 89.846 ± 0.002° |
| γ | 80.988 ± 0.002° |
| Cell volume | 1623.48 ± 0.09 Å3 |
| Cell temperature | 100 ± 0.1 K |
| Ambient diffraction temperature | 100 ± 0.1 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 | 0.0634 |
| Residual factor for significantly intense reflections | 0.0565 |
| Weighted residual factors for significantly intense reflections | 0.1498 |
| Weighted residual factors for all reflections included in the refinement | 0.1555 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.04 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 1.54184 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 293239 (current) | 2024-07-05 | cif/ Updating files of 7159928 Original log message: Adding full bibliography for 7159928.cif. |
7159928.cif |
| 291453 | 2024-05-02 | cif/ Adding structures of 7159928 via cif-deposit CGI script. |
7159928.cif |
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Users of the data should acknowledge the original authors of the
structural data.