Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 7135163
Preview
| Coordinates | 7135163.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C23 H26 N2 O |
|---|---|
| Calculated formula | C23 H26 N2 O |
| Title of publication | Palladium-catalyzed aminoalkynylation/alleneamination of urea-tethered alkenes: access to imidazolidinones bearing alkynes and allenes. |
| Authors of publication | Hu, Qianqian; Hu, Cangzhu; Tang, Tian; Wu, Qing; Hu, Weiming; Dai, Qiang; Wang, Lei |
| Journal of publication | Chemical communications (Cambridge, England) |
| Year of publication | 2025 |
| Journal volume | 61 |
| Journal issue | 91 |
| Pages of publication | 17898 - 17901 |
| a | 14.5518 ± 0.0013 Å |
| b | 7.7103 ± 0.0007 Å |
| c | 18.9048 ± 0.0019 Å |
| α | 90° |
| β | 110.142 ± 0.003° |
| γ | 90° |
| Cell volume | 1991.4 ± 0.3 Å3 |
| Cell temperature | 273 ± 2 K |
| Ambient diffraction temperature | 273.15 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 | 0.1281 |
| Residual factor for significantly intense reflections | 0.0564 |
| Weighted residual factors for significantly intense reflections | 0.1272 |
| Weighted residual factors for all reflections included in the refinement | 0.1553 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.013 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 303254 (current) | 2025-11-12 | cif/ Adding structures of 7135162, 7135163 via cif-deposit CGI script. |
7135163.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.