Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 7057414
Preview
| Coordinates | 7057414.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C42 H42 Br Cu N2 P2 S |
|---|---|
| Calculated formula | C42 H42 Br Cu N2 P2 S |
| Title of publication | Synthesis, structures and antimicrobial activity of copper derivatives of N-substituted imidazolidine-2-thiones: unusual bio-activity against Staphylococcus epidermidis and Enterococcus faecalis |
| Authors of publication | Lobana, Tarlok S.; Aulakh, Jaspreet K.; Sood, Heena; Arora, Daljit S.; Garcia-Santos, Isabel; Kaur, Manpreet; Duff, Courtney E.; Jasinski, Jerry P. |
| Journal of publication | New Journal of Chemistry |
| Year of publication | 2018 |
| Journal volume | 42 |
| Journal issue | 12 |
| Pages of publication | 9886 |
| a | 13.0009 ± 0.0002 Å |
| b | 20.8461 ± 0.0004 Å |
| c | 14.707 ± 0.0003 Å |
| α | 90° |
| β | 105.105 ± 0.002° |
| γ | 90° |
| Cell volume | 3848.15 ± 0.13 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 7 |
| 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 | 0.0488 |
| Residual factor for significantly intense reflections | 0.0416 |
| Weighted residual factors for significantly intense reflections | 0.1102 |
| Weighted residual factors for all reflections included in the refinement | 0.1168 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.033 |
| 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 |
|---|---|---|---|
| 230546 (current) | 2019-11-17 | cif/ Updating files of 7057409, 7057410, 7057411, 7057412, 7057413, 7057414, 7057415, 7057416, 7057417, 7057418, 7057419, 7057420 Original log message: Adding full bibliography for 7057409--7057420.cif. |
7057414.cif |
| 207709 | 2018-05-09 | cif/ Adding structures of 7057409, 7057410, 7057411, 7057412, 7057413, 7057414, 7057415, 7057416, 7057417, 7057418, 7057419, 7057420 via cif-deposit CGI script. |
7057414.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.