Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 1543504
Preview
| Coordinates | 1543504.cif |
|---|---|
| Structure factors | 1543504.hkl |
| Original paper (by DOI) | HTML |
| Chemical name | 4'-(3,4-Dimethoxyphenyl)-2,2':6',2''-terpyridine |
|---|---|
| Formula | C23 H19 N3 O2 |
| Calculated formula | C23 H19 N3 O2 |
| Title of publication | 4'-(3,4-Dimethoxyphenyl)-2,2':6',2''-terpyridine |
| Authors of publication | Takase, Tsugiko; Soga, Yuka; Oyama, Dai |
| Journal of publication | IUCrData |
| Year of publication | 2016 |
| Journal volume | 1 |
| Journal issue | 6 |
| Pages of publication | x160950 |
| a | 18.28 ± 0.014 Å |
| b | 5.493 ± 0.004 Å |
| c | 18.298 ± 0.014 Å |
| α | 90° |
| β | 96.02 ± 0.006° |
| γ | 90° |
| Cell volume | 1827 ± 2 Å3 |
| Cell temperature | 93 K |
| Ambient diffraction temperature | 93 K |
| Number of distinct elements | 4 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/a 1 |
| Hall space group symbol | -P 2yab |
| Residual factor for significantly intense reflections | 0.0998 |
| Weighted residual factors for all reflections included in the refinement | 0.2237 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.144 |
| Diffraction radiation wavelength | 0.71075 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 183850 (current) | 2016-06-23 | cif/ hkl/ Adding structures of 1543504 via cif-deposit CGI script. |
1543504.cif 1543504.hkl |
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.