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Information card for entry 1577430
Preview
| Coordinates | 1577430.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Chemical name | 2-Benzyl-4,5-dihydro-1H-imidazole (HCl salt) |
|---|---|
| Formula | C10 H13 Cl N2 |
| Calculated formula | C10 H13 Cl N2 |
| Title of publication | Direct access to 2-imidazolines from unactivated alkenes |
| Authors of publication | Schiele, Stefanie; Paschke, Ann-Sophie K.; Romiti, Giorgia; Morandi, Bill |
| Journal of publication | Chemical Science |
| Year of publication | 2026 |
| a | 8.8392 ± 0.0002 Å |
| b | 9.4499 ± 0.0001 Å |
| c | 12.2464 ± 0.0002 Å |
| α | 90° |
| β | 103.098 ± 0.002° |
| γ | 90° |
| Cell volume | 996.32 ± 0.03 Å3 |
| Cell temperature | 100 ± 0.1 K |
| Ambient diffraction temperature | 100 ± 0.1 K |
| Number of distinct elements | 4 |
| 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 | 0.0355 |
| Residual factor for significantly intense reflections | 0.0332 |
| Weighted residual factors for significantly intense reflections | 0.0912 |
| Weighted residual factors for all reflections included in the refinement | 0.0936 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.058 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 1.54184 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
Version history
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