Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 7160657
Preview
| Coordinates | 7160657.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C30 H22 N2 |
|---|---|
| Calculated formula | C30 H22 N2 |
| Title of publication | Copper catalyzed synthesis of polysubstituted benzimidazoles; an efficient one-pot synthetic approach to N-enylated benzimidazoles |
| Authors of publication | Mohaghegh, Farid; Jafarpour, Farnaz |
| Journal of publication | Organic & Biomolecular Chemistry |
| Year of publication | 2025 |
| a | 10.024 ± 0.002 Å |
| b | 20.33 ± 0.004 Å |
| c | 11.444 ± 0.002 Å |
| α | 90° |
| β | 104.69 ± 0.03° |
| γ | 90° |
| Cell volume | 2255.9 ± 0.8 Å3 |
| Cell temperature | 290 K |
| Ambient diffraction temperature | 290 K |
| Number of distinct elements | 3 |
| 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 | 0.0726 |
| Residual factor for significantly intense reflections | 0.0642 |
| Weighted residual factors for significantly intense reflections | 0.1718 |
| Weighted residual factors for all reflections included in the refinement | 0.1816 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.099 |
| 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 |
|---|---|---|---|
| 301677 (current) | 2025-08-07 | cif/ Adding structures of 7160657 via cif-deposit CGI script. |
7160657.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.