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Information card for entry 4086265
Preview
| Coordinates | 4086265.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Common name | jonlm27 |
|---|---|
| Chemical name | Pd(dippe)(Stolyl)(Ph) |
| Formula | C30.5 H48 P2 Pd S |
| Calculated formula | C30.5 H48 P2 Pd S |
| Title of publication | Mechanistic Insights in the Exchange of Arylthiolate Groups in Aryl(arylthiolato)palladium Complexes Supported by a Dippe Ligand |
| Authors of publication | Munjanja, Lloyd; Brennessel, William W.; Jones, William D. |
| Journal of publication | Organometallics |
| Year of publication | 2015 |
| Journal volume | 34 |
| Journal issue | 18 |
| Pages of publication | 4574 |
| a | 8.5536 ± 0.0011 Å |
| b | 11.3855 ± 0.0015 Å |
| c | 16.083 ± 0.002 Å |
| α | 83.832 ± 0.003° |
| β | 84.05 ± 0.003° |
| γ | 78.966 ± 0.003° |
| Cell volume | 1522.9 ± 0.3 Å3 |
| Cell temperature | 100 ± 0.5 K |
| Ambient diffraction temperature | 100 ± 0.5 K |
| Number of distinct elements | 5 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.1279 |
| Residual factor for significantly intense reflections | 0.063 |
| Weighted residual factors for significantly intense reflections | 0.104 |
| Weighted residual factors for all reflections included in the refinement | 0.1239 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.005 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301831 (current) | 2025-08-20 | Add cross-references to PubChem compounds in COD range 4/08/ Each referenced PubChem compound corresponds to the full crystal structure. |
4086265.cif |
| 160430 | 2015-10-06 | cif/ Adding structures of 4086262, 4086263, 4086264, 4086265, 4086266, 4086267, 4086268 via cif-deposit CGI script. |
4086265.cif |
All data in the COD and the database itself are dedicated to the
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CC0
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.
Users of the data should acknowledge the original authors of the
structural data.