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Information card for entry 1571300
Preview
| Coordinates | 1571300.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C32 H28 F3 N O2 |
|---|---|
| Calculated formula | C32 H28 F3 N O2 |
| Title of publication | Visible-light-enabled stereoselective synthesis of functionalized cyclohexylamine derivatives <i>via</i> [4 + 2] cycloadditions. |
| Authors of publication | Lu, Yi-Nan; Che, Chao; Zhen, Guangjin; Chang, Xin; Dong, Xiu-Qin; Wang, Chun-Jiang |
| Journal of publication | Chemical science |
| Year of publication | 2024 |
| Journal volume | 15 |
| Journal issue | 17 |
| Pages of publication | 6507 - 6514 |
| a | 9.5911 ± 0.0001 Å |
| b | 23.4883 ± 0.0004 Å |
| c | 11.486 ± 0.0002 Å |
| α | 90° |
| β | 97.703 ± 0.001° |
| γ | 90° |
| Cell volume | 2564.2 ± 0.07 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100.15 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 | 0.0485 |
| Residual factor for significantly intense reflections | 0.038 |
| Weighted residual factors for significantly intense reflections | 0.0955 |
| Weighted residual factors for all reflections included in the refinement | 0.1006 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.083 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 1.54178 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 291564 (current) | 2024-05-05 | cif/ Updating files of 1571298, 1571299, 1571300 Original log message: Adding full bibliography for 1571298--1571300.cif. |
1571300.cif |
| 290652 | 2024-03-27 | cif/ Adding structures of 1571298, 1571299, 1571300 via cif-deposit CGI script. |
1571300.cif |
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Users of the data should acknowledge the original authors of the
structural data.