Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 2237227
Preview
| Coordinates | 2237227.cif |
|---|---|
| Structure factors | 2237227.hkl |
| Original IUCr paper | HTML |
| Chemical name | μ-Azido-κ^2^<i>N</i>^1^:<i>N</i>^1^-μ-chlorido-bis[(2-chloro-3- dimethylamino-1-phenylprop-1-en-1-yl-κ^2^<i>C</i>^1^,<i>N</i>)palladium(II)] chloroform monosolvate |
|---|---|
| Formula | C23 H27 Cl6 N5 Pd2 |
| Calculated formula | C23 H27 Cl6 N5 Pd2 |
| SMILES | [Pd]12(C(c3ccccc3)=C(Cl)C[N]2(C)C)[Cl][Pd]2([N]1=N#N)[N](CC(=C2c1ccccc1)Cl)(C)C.ClC(Cl)Cl |
| Title of publication | μ-Azido-κ^2^<i>N</i>^1^:<i>N</i>^1^-μ-chlorido-bis[(2-chloro-3-dimethylamino-1-phenylprop-1-en-1-yl-κ^2^<i>C</i>^1^,<i>N</i>)palladium(II)] chloroform monosolvate |
| Authors of publication | Mafud, Ana C.; Oliviera, Milene A. R.; Gambardella, Maria T. P. |
| Journal of publication | Acta Crystallographica Section E |
| Year of publication | 2013 |
| Journal volume | 69 |
| Journal issue | 1 |
| Pages of publication | m15 |
| a | 15.416 ± 0.003 Å |
| b | 11.474 ± 0.003 Å |
| c | 17.094 ± 0.004 Å |
| α | 90° |
| β | 97.14 ± 0.02° |
| γ | 90° |
| Cell volume | 3000.2 ± 1.2 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/c 1 |
| Hall space group symbol | -P 2ybc |
| Residual factor for all reflections | 0.2376 |
| Residual factor for significantly intense reflections | 0.0634 |
| Weighted residual factors for all reflections included in the refinement | 0.1697 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.932 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/2237227.html
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.