Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 7229716
Preview
| Coordinates | 7229716.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C41 H33 N3 O3 S |
|---|---|
| Calculated formula | C41 H25 N3 O3 S |
| Title of publication | Stereoelectronic control of oxidation potentials of 3,7-bis(diarylamino)phenothiazines |
| Authors of publication | Karimata, Ayumu; Suzuki, Shuichi; Kozaki, Masatoshi; Okada, Keiji |
| Journal of publication | RSC Advances |
| Year of publication | 2017 |
| Journal volume | 7 |
| Journal issue | 88 |
| Pages of publication | 56144 |
| a | 28.24 ± 0.03 Å |
| b | 20.01 ± 0.02 Å |
| c | 5.663 ± 0.006 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 3200 ± 6 Å3 |
| Cell temperature | 200 K |
| Ambient diffraction temperature | 200 K |
| Number of distinct elements | 5 |
| Space group number | 62 |
| Hermann-Mauguin space group symbol | P n m a |
| Hall space group symbol | -P 2ac 2n |
| Residual factor for significantly intense reflections | 0.0937 |
| Weighted residual factors for all reflections included in the refinement | 0.2277 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.724 |
| Diffraction radiation wavelength | 0.71075 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 204214 (current) | 2017-12-13 | cif/ Adding structures of 7229710, 7229711, 7229712, 7229713, 7229714, 7229715, 7229716, 7229717, 7229718, 7229719, 7229720, 7229721 via cif-deposit CGI script. |
7229716.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.