Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 7238730
Preview
| Coordinates | 7238730.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C26 H20 N2 O2 S |
|---|---|
| Calculated formula | C26 H20 N2 O2 S |
| Title of publication | Solid-state thermo- and photochromism in N,N′-bis(5-X-salicylidene)diamines (X = H, Br) |
| Authors of publication | Safin, Damir A.; Robeyns, Koen; Garcia, Yann |
| Journal of publication | RSC Advances |
| Year of publication | 2012 |
| Journal volume | 2 |
| Journal issue | 30 |
| Pages of publication | 11379 |
| a | 5.5937 ± 0.0003 Å |
| b | 42.721 ± 0.003 Å |
| c | 8.7533 ± 0.0006 Å |
| α | 90° |
| β | 96.129 ± 0.006° |
| γ | 90° |
| Cell volume | 2079.8 ± 0.2 Å3 |
| Cell temperature | 297 ± 2 K |
| Ambient diffraction temperature | 297 ± 2 K |
| Number of distinct elements | 5 |
| 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 | 0.0619 |
| Residual factor for significantly intense reflections | 0.0464 |
| Weighted residual factors for significantly intense reflections | 0.1208 |
| Weighted residual factors for all reflections included in the refinement | 0.1316 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.997 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 244319 (current) | 2019-11-28 | cif/ Adding structures of 7238729, 7238730, 7238731, 7238732, 7238733 via cif-deposit CGI script. |
7238730.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.