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Information card for entry 4071781
Preview
| Coordinates | 4071781.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C30 H35 Cl4 O3 P Pt |
|---|---|
| Calculated formula | C30 H35 Cl4 O3 P Pt |
| SMILES | [Pt]12([P](c3c(cc(OC)cc3)[C]1(=[CH2]2)C)(c1c(cc(OC)c(c1)Cl)C(C)C)c1c(cc(OC)c(Cl)c1)C(C)C)(Cl)Cl |
| Title of publication | Oxidative Dehydrogenation of Tris(o-isopropylphenyl)phosphines by Platinum Complexes |
| Authors of publication | Baber, Angharad; Fan, Cheng; Norman, David W.; Orpen, A. Guy; Pringle, Paul G.; Wingad, Richard L. |
| Journal of publication | Organometallics |
| Year of publication | 2008 |
| Journal volume | 27 |
| Journal issue | 22 |
| Pages of publication | 5906 |
| a | 13.348 ± 0.003 Å |
| b | 15.743 ± 0.003 Å |
| c | 15.33 ± 0.003 Å |
| α | 90° |
| β | 109.57 ± 0.03° |
| γ | 90° |
| Cell volume | 3035.3 ± 1.2 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 K |
| Number of distinct elements | 6 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/c 1 |
| Hall space group symbol | -P 2ybc |
| Residual factor for all reflections | 0.1131 |
| Residual factor for significantly intense reflections | 0.0951 |
| Weighted residual factors for significantly intense reflections | 0.1837 |
| Weighted residual factors for all reflections included in the refinement | 0.1924 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.274 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 0.71074 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 178606 (current) | 2016-03-21 | cif/4/07/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/07/17. |
4071781.cif |
| 91935 | 2013-12-29 | cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs. |
4071781.cif |
| 47256 | 2012-03-23 | cif/4/ Distributing the new range 4 CIFs into their appropriate prefixed subdirectories. |
4071781.cif |
| 44036 | 2012-03-15 | ../uploads/cif-deposit/cod/cif Adding structures of 4071781 via cif-deposit CGI script. |
4071781.cif |
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Users of the data should acknowledge the original authors of the
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