Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 7160638
Preview
| Coordinates | 7160638.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C24 H18 N4 O |
|---|---|
| Calculated formula | C24 H18 N4 O |
| Title of publication | One-pot Synthesis of Sulfonyl 3,6-Diarylpyridazines via Tandem Condensation of α-Sulfonyl Ketones with Methyl Ketones |
| Authors of publication | Chang, Meng-Yang; Chen-Yo, Ou |
| Journal of publication | Organic & Biomolecular Chemistry |
| Year of publication | 2025 |
| a | 11.1986 ± 0.0002 Å |
| b | 7.4553 ± 0.0001 Å |
| c | 21.8767 ± 0.0003 Å |
| α | 90° |
| β | 92.888 ± 0.002° |
| γ | 90° |
| Cell volume | 1824.14 ± 0.05 Å3 |
| Cell temperature | 130 ± 2 K |
| Ambient diffraction temperature | 130 ± 2 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 | 0.0441 |
| Residual factor for significantly intense reflections | 0.0384 |
| Weighted residual factors for significantly intense reflections | 0.0964 |
| Weighted residual factors for all reflections included in the refinement | 0.0997 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.097 |
| 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 |
|---|---|---|---|
| 301275 (current) | 2025-07-17 | cif/ Adding structures of 7160636, 7160637, 7160638, 7160639 via cif-deposit CGI script. |
7160638.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.