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Information card for entry 4308841
Preview
| Coordinates | 4308841.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C36 H46 Cl3 F3 N4 O3 P2 Pd S |
|---|---|
| Calculated formula | C36 H46 Cl3 F3 N4 O3 P2 Pd S |
| Title of publication | Platinum(II) and Palladium(II) Complexes of Bisphosphine Ligands Bearing o-N,N-Dimethylanilinyl Substituents: A Hint of Catalytic Olefin Hydration |
| Authors of publication | Nathan D. Jones; Patric Meessen; Udo Losehand; Brian O. Patrick; Brian R. James |
| Journal of publication | Inorganic Chemistry |
| Year of publication | 2005 |
| Journal volume | 44 |
| Pages of publication | 3290 - 3298 |
| a | 9.9087 ± 0.0009 Å |
| b | 11.2071 ± 0.0004 Å |
| c | 20.0765 ± 0.001 Å |
| α | 87.556 ± 0.002° |
| β | 86.209 ± 0.002° |
| γ | 70.624 ± 0.002° |
| Cell volume | 2098.1 ± 0.2 Å3 |
| Cell temperature | 173 ± 2 K |
| Ambient diffraction temperature | 173 ± 2 K |
| Number of distinct elements | 9 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0522 |
| Residual factor for significantly intense reflections | 0.0379 |
| Weighted residual factors for significantly intense reflections | 0.0896 |
| Weighted residual factors for all reflections included in the refinement | 0.0959 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.055 |
| Diffraction radiation wavelength | 0.71069 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301836 (current) | 2025-08-20 | Add cross-references to PubChem compounds in COD range 4/30/ Each referenced PubChem compound corresponds to the full crystal structure. |
4308841.cif |
| 179126 | 2016-03-22 | cif/4/30/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/30/88. |
4308841.cif |
| 120081 | 2014-07-11 | Adding DOIs to range 4/30 structures. | 4308841.cif |
| 34330 | 2012-02-24 | cif/4/ Reorganising CIF range 4 into a prefix tree. |
4308841.cif |
| 1526 | 2010-09-26 | cif/4/ Adding new CIFs from Inorg. Chem. 2005 deposited via Web deposition site to the COD test database (and transferede to the main COD database after renaming). |
4308841.cif |
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Users of the data should acknowledge the original authors of the
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