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Information card for entry 7017706
Preview
| Coordinates | 7017706.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C32 H32 Cl2 N2 Ni O2 P2 |
|---|---|
| Calculated formula | C32 H32 Cl2 N2 Ni O2 P2 |
| SMILES | c1(ccccc1)[P]1([Ni]2([N]3CCOC=3C1)([N]1CCOC=1C[P]2(c1ccccc1)c1ccccc1)(Cl)Cl)c1ccccc1 |
| Title of publication | A phosphino-oxazoline ligand as a P,N-bridge in palladium/cobalt or P,N-chelate in nickel complexes: catalytic ethylene oligomerization. |
| Authors of publication | Zhang, Shuanming; Pattacini, Roberto; Jie, Suyun; Braunstein, Pierre |
| Journal of publication | Dalton transactions (Cambridge, England : 2003) |
| Year of publication | 2012 |
| Journal volume | 41 |
| Journal issue | 2 |
| Pages of publication | 379 - 386 |
| a | 8.2701 ± 0.0002 Å |
| b | 15.3634 ± 0.0007 Å |
| c | 24.168 ± 0.001 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 3070.7 ± 0.2 Å3 |
| Cell temperature | 173 ± 2 K |
| Ambient diffraction temperature | 173 ± 2 K |
| Number of distinct elements | 7 |
| Space group number | 61 |
| Hermann-Mauguin space group symbol | P b c a |
| Hall space group symbol | -P 2ac 2ab |
| Residual factor for all reflections | 0.0958 |
| Residual factor for significantly intense reflections | 0.044 |
| Weighted residual factors for significantly intense reflections | 0.1092 |
| Weighted residual factors for all reflections included in the refinement | 0.1487 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.065 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 179881 (current) | 2016-03-25 | cif/7/01/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/01/77. |
7017706.cif |
| 120112 | 2014-07-12 | Adding DOIs to range 7 structures. | 7017706.cif |
| 35909 | 2012-02-26 | cif/7/: reorganising range 7 into a prefix-directory tree. | 7017706.cif |
| 33396 | 2012-02-12 | ../uploads/cif-deposit/cod/cif Adding structures of 7017705, 7017706, 7017707, 7017708 via cif-deposit CGI script. |
7017706.cif |
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