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Information card for entry 7008150
Preview
| Coordinates | 7008150.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C63 H84 As2 Cl8 O6 Pt |
|---|---|
| Calculated formula | C63 H84 As2 Cl8 O6 Pt |
| SMILES | [Pt]([As](c1c(C(C)C)cc(cc1)OC)(c1ccc(cc1C(C)C)OC)c1c(cc(cc1)OC)C(C)C)([As](c1ccc(cc1C(C)C)OC)(c1ccc(OC)cc1C(C)C)c1ccc(cc1C(C)C)OC)(Cl)Cl.ClCCl.ClCCl.ClCCl |
| Title of publication | Bulky triarylarsines are effective ligands for palladium catalysed Heck olefination. |
| Authors of publication | Baber, R. Angharad; Collard, Simon; Hooper, Mark; Orpen, A. Guy; Pringle, Paul G.; Wilkinson, Matthew J.; Wingad, Richard L. |
| Journal of publication | Dalton transactions (Cambridge, England : 2003) |
| Year of publication | 2005 |
| Journal issue | 8 |
| Pages of publication | 1491 - 1498 |
| a | 14.116 ± 0.003 Å |
| b | 24.806 ± 0.005 Å |
| c | 19.594 ± 0.004 Å |
| α | 90° |
| β | 99.57 ± 0.03° |
| γ | 90° |
| Cell volume | 6766 ± 2 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 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 | 0.0781 |
| Residual factor for significantly intense reflections | 0.0654 |
| Weighted residual factors for significantly intense reflections | 0.1558 |
| Weighted residual factors for all reflections included in the refinement | 0.1636 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.096 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 179785 (current) | 2016-03-25 | cif/7/00/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/00/81. |
7008150.cif |
| 120443 | 2014-07-15 | Adding 17924 DOIs guessed from source file names. | 7008150.cif |
| 35909 | 2012-02-26 | cif/7/: reorganising range 7 into a prefix-directory tree. | 7008150.cif |
| 1504 | 2010-09-08 | cif/7/ Adding data extracted from RSC 2005 and 2006 year publications. |
7008150.cif |
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Users of the data should acknowledge the original authors of the
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