Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 1572957
Preview
| Coordinates | 1572957.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Chemical name | (<i>Z</i>)-<i>N</i>-(2,6-Dimethylphenyl)-1-[(2-methoxyphenyl)amino]methanimine oxide methanol monosolvate |
|---|---|
| Formula | C17 H22 N2 O3 |
| Calculated formula | C17 H22 N2 O3 |
| a | 7.3519 ± 0.0005 Å |
| b | 28.4173 ± 0.0019 Å |
| c | 7.8982 ± 0.0005 Å |
| α | 90° |
| β | 94.481 ± 0.002° |
| γ | 90° |
| Cell volume | 1645.06 ± 0.19 Å3 |
| Cell temperature | 296 ± 2 K |
| Ambient diffraction temperature | 296.15 K |
| Number of distinct elements | 4 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/n 1 |
| Hall space group symbol | -P 2yn |
| Residual factor for all reflections | 0.0443 |
| Residual factor for significantly intense reflections | 0.0382 |
| Weighted residual factors for significantly intense reflections | 0.0911 |
| Weighted residual factors for all reflections included in the refinement | 0.0945 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.037 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 295629 (current) | 2024-10-25 | cif/ Adding structures of 1572957 via cif-deposit CGI script. |
1572957.cif |
All data in the COD and the database itself are dedicated to the
public domain and licensed under the
CC0
License
.
Users of the data should acknowledge the original authors of the
structural data.