Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 2240536
Preview
| Coordinates | 2240536.cif |
|---|---|
| Structure factors | 2240536.hkl |
| Original IUCr paper | HTML |
| Chemical name | Dichlorido(8-diphenylphosphanylquinoline)palladium(II) |
|---|---|
| Formula | C21 H16 Cl2 N P Pd |
| Calculated formula | C21 H16 Cl2 N P Pd |
| SMILES | [Pd]1(Cl)(Cl)[P](c2cccc3ccc[n]1c23)(c1ccccc1)c1ccccc1 |
| Title of publication | Crystal structures of dichloridopalladium(II), -platinum(II) and -rhodium(III) complexes containing 8-(diphenylphosphanyl)quinoline |
| Authors of publication | Suzuki, Takayoshi; Yamaguchi, Hiroshi; Fujiki, Masayuki; Hashimoto, Akira; Takagi, Hideo D. |
| Journal of publication | Acta Crystallographica Section E |
| Year of publication | 2015 |
| Journal volume | 71 |
| Journal issue | 5 |
| Pages of publication | 447 - 451 |
| a | 9.0293 ± 0.0005 Å |
| b | 15.2154 ± 0.0008 Å |
| c | 13.7936 ± 0.0006 Å |
| α | 90° |
| β | 91.8197 ± 0.0013° |
| γ | 90° |
| Cell volume | 1894.07 ± 0.17 Å3 |
| Cell temperature | 200 ± 2 K |
| Ambient diffraction temperature | 200 ± 2 K |
| Number of distinct elements | 6 |
| 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 | 0.0315 |
| Residual factor for significantly intense reflections | 0.0282 |
| Weighted residual factors for significantly intense reflections | 0.0713 |
| Weighted residual factors for all reflections included in the refinement | 0.0744 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.918 |
| Diffraction radiation wavelength | 0.71075 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 181905 (current) | 2016-04-06 | hkl/2/24/ (antanas@echidna) Adding IUCr specific svn headers to multiple entries in subrange 2/24/05 |
2240536.cif 2240536.hkl |
| 181325 | 2016-04-03 | hkl/2/24/ (antanas@echidna) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 2/24/05. |
2240536.cif 2240536.hkl |
| 176809 | 2016-02-21 | cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 2. |
2240536.cif 2240536.hkl |
| 134590 | 2015-04-02 | cif/ hkl/ Adding structures of 2240536, 2240537, 2240538 via cif-deposit CGI script. |
2240536.cif 2240536.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.