Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 1519471
Preview
| Coordinates | 1519471.cif |
|---|
| Formula | C28 H34 Cl2 O9.5 P Zn0.5 |
|---|---|
| Calculated formula | C28 H34 Cl2 O9.5 P Zn0.5 |
| Title of publication | C27H33Cl2O9PZn |
| Authors of publication | Bell, Norman A.; Coles, Simon J.; Hursthouse, Michael B. |
| Journal of publication | Crystal Structure Report Archive |
| Year of publication | 2002 |
| Pages of publication | 882 |
| a | 30.1313 ± 0.0004 Å |
| b | 9.8927 ± 0.0002 Å |
| c | 23.0654 ± 0.0005 Å |
| α | 90° |
| β | 118.397 ± 0.001° |
| γ | 90° |
| Cell volume | 6048 ± 0.2 Å3 |
| Cell temperature | 150 ± 2 K |
| Ambient diffraction temperature | 150 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 15 |
| Hermann-Mauguin space group symbol | C 1 2/c 1 |
| Hall space group symbol | -C 2yc |
| Residual factor for all reflections | 0.06 |
| Residual factor for significantly intense reflections | 0.0428 |
| Weighted residual factors for significantly intense reflections | 0.104 |
| Weighted residual factors for all reflections included in the refinement | 0.1127 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.026 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 176435 (current) | 2016-02-14 | cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries from ranges 1, 2. |
1519471.cif |
| 136027 | 2015-05-11 | cif/ Adding structures of 1519471 via cif-deposit CGI script. |
1519471.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.