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Information card for entry 2243707
Preview
| Coordinates | 2243707.cif |
|---|---|
| Structure factors | 2243707.hkl |
| Original paper (by DOI) | HTML |
| Chemical name | Dichlorido[8-(diphenylphosphanyl)-2-phenylquinoline-κ^2^<i>N</i.,<i>P</i>]palladium(II) |
|---|---|
| Formula | C27 H20 Cl2 N P Pd |
| Calculated formula | C27 H20 Cl2 N P Pd |
| SMILES | [Pd]1(Cl)(Cl)[P](c2cccc3ccc([n]1c23)c1ccccc1)(c1ccccc1)c1ccccc1 |
| Title of publication | Crystal and molecular structures of dichloridopalladium(II) containing 2-methyl- or 2-phenyl-8-(diphenyphosphanyl)quinoline |
| Authors of publication | Mori, Masatoshi; Namioka, Atsushi; Suzuki, Takayoshi |
| Journal of publication | Acta Crystallographica Section E |
| Year of publication | 2021 |
| Journal volume | 77 |
| Journal issue | 1 |
| Pages of publication | 52 - 57 |
| a | 9.6582 ± 0.0013 Å |
| b | 9.8765 ± 0.0014 Å |
| c | 13.0748 ± 0.0014 Å |
| α | 102.011 ± 0.004° |
| β | 90.426 ± 0.004° |
| γ | 109.827 ± 0.004° |
| Cell volume | 1143.4 ± 0.3 Å3 |
| Cell temperature | 188 ± 2 K |
| Ambient diffraction temperature | 188 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0283 |
| Residual factor for significantly intense reflections | 0.0247 |
| Weighted residual factors for significantly intense reflections | 0.0624 |
| Weighted residual factors for all reflections included in the refinement | 0.0637 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.059 |
| Diffraction radiation wavelength | 0.71075 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 259927 (current) | 2020-12-16 | cif/ hkl/ Adding structures of 2243706, 2243707 via cif-deposit CGI script. |
2243707.cif 2243707.hkl |
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Users of the data should acknowledge the original authors of the
structural data.