Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 7160186
Preview
| Coordinates | 7160186.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C23 H19 N O2 |
|---|---|
| Calculated formula | C23 H19 N O2 |
| Title of publication | Triflic-acid promoted post-Ugi condensation for the assembly of 2,6-diarylmorpholin-3-ones |
| Authors of publication | Amire, Niyaz; Almagambetova, Kamila M.; Turlykul, Assel; Taishybay, Aidyn; Nuroldayeva, Gulzat; Belyaev, Andrey; Peshkov, Anatoly A.; Utepbergenov, Darkhan; Peshkov, Vsevolod A. |
| Journal of publication | Organic & Biomolecular Chemistry |
| Year of publication | 2024 |
| a | 5.3926 ± 0.0001 Å |
| b | 9.5816 ± 0.0002 Å |
| c | 16.9103 ± 0.0004 Å |
| α | 90° |
| β | 90.234 ± 0.002° |
| γ | 90° |
| Cell volume | 873.74 ± 0.03 Å3 |
| Cell temperature | 120 ± 0.1 K |
| Ambient diffraction temperature | 120 ± 0.1 K |
| Number of distinct elements | 4 |
| Space group number | 4 |
| Hermann-Mauguin space group symbol | P 1 21 1 |
| Hall space group symbol | P 2yb |
| Residual factor for all reflections | 0.0345 |
| Residual factor for significantly intense reflections | 0.0329 |
| Weighted residual factors for significantly intense reflections | 0.0881 |
| Weighted residual factors for all reflections included in the refinement | 0.0894 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.067 |
| 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 |
|---|---|---|---|
| 295513 (current) | 2024-10-17 | cif/ Adding structures of 7160185, 7160186, 7160187 via cif-deposit CGI script. |
7160186.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.