Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 7159764
Preview
| Coordinates | 7159764.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Chemical name | C34H28BrN3O2 |
|---|---|
| Formula | C34 H28 Br N3 O2 |
| Calculated formula | C34 H28 Br N3 O2 |
| Title of publication | Picolinamide-assisted ortho-C–H functionalization of pyrenylglycine derivatives using aryl iodides |
| Authors of publication | Dalal, Arup; Bodak, Subhankar; Babu, Srinivasarao Arulananda |
| Journal of publication | Organic & Biomolecular Chemistry |
| Year of publication | 2024 |
| Journal volume | 22 |
| Journal issue | 6 |
| Pages of publication | 1279 - 1298 |
| a | 9.6137 ± 0.0019 Å |
| b | 18.354 ± 0.003 Å |
| c | 18.491 ± 0.003 Å |
| α | 61.325 ± 0.017° |
| β | 89.722 ± 0.015° |
| γ | 89.85 ± 0.015° |
| Cell volume | 2862.5 ± 1 Å3 |
| Cell temperature | 293 K |
| Ambient diffraction temperature | 293 K |
| Number of distinct elements | 5 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.1263 |
| Residual factor for significantly intense reflections | 0.0597 |
| Weighted residual factors for significantly intense reflections | 0.1582 |
| Weighted residual factors for all reflections included in the refinement | 0.2088 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1 |
| 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 |
|---|---|---|---|
| 290265 (current) | 2024-03-04 | cif/ Updating files of 7159764 Original log message: Adding full bibliography for 7159764.cif. |
7159764.cif |
| 289045 | 2024-01-12 | cif/ Adding structures of 7159764 via cif-deposit CGI script. |
7159764.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.