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Information card for entry 7160699
Preview
| Coordinates | 7160699.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C23 H19 N O2 |
|---|---|
| Calculated formula | C23 H19 N O2 |
| Title of publication | Organocatalytic modular synthesis of 2-functionalized 2,5-dihydrofuran from γ-hydroxy enal |
| Authors of publication | Lei, Tie; Tan, Jun; Zhang, Yifei; Ma, Dengke |
| Journal of publication | Organic & Biomolecular Chemistry |
| Year of publication | 2025 |
| a | 9.6716 ± 0.0002 Å |
| b | 16.7005 ± 0.0005 Å |
| c | 11.2891 ± 0.0003 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 1823.42 ± 0.08 Å3 |
| Cell temperature | 180 ± 0.1 K |
| Ambient diffraction temperature | 180 ± 0.1 K |
| Number of distinct elements | 4 |
| Space group number | 33 |
| Hermann-Mauguin space group symbol | P n a 21 |
| Hall space group symbol | P 2c -2n |
| Residual factor for all reflections | 0.0465 |
| Residual factor for significantly intense reflections | 0.0371 |
| Weighted residual factors for significantly intense reflections | 0.0885 |
| Weighted residual factors for all reflections included in the refinement | 0.0928 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.066 |
| 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 |
|---|---|---|---|
| 301886 (current) | 2025-08-24 | cif/ Adding structures of 7160699 via cif-deposit CGI script. |
7160699.cif |
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Users of the data should acknowledge the original authors of the
structural data.