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Information card for entry 4084546
Preview
| Coordinates | 4084546.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Common name | [NiCl2{ImMes(EtOMe)}2] |
|---|---|
| Formula | C30 H40 Cl2 N4 Ni O2 |
| Calculated formula | C30 H40 Cl2 N4 Ni O2 |
| Title of publication | Bis(ether-functionalized NHC) Nickel(II) Complexes,TranstoCisIsomerization Triggered by Water Coordination, and Catalytic Ethylene Oligomerization |
| Authors of publication | Hameury, Sophie; de Frémont, Pierre; Breuil, Pierre-Alain R.; Olivier-Bourbigou, Hélène; Braunstein, Pierre |
| Journal of publication | Organometallics |
| Year of publication | 2015 |
| Journal volume | 34 |
| Journal issue | 11 |
| Pages of publication | 2183 |
| a | 10.8374 ± 0.0005 Å |
| b | 11.2012 ± 0.0005 Å |
| c | 15.5473 ± 0.0009 Å |
| α | 92.137 ± 0.003° |
| β | 108.231 ± 0.003° |
| γ | 117.727 ± 0.002° |
| Cell volume | 1548.77 ± 0.14 Å3 |
| Cell temperature | 173 ± 2 K |
| Ambient diffraction temperature | 173 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0878 |
| Residual factor for significantly intense reflections | 0.0492 |
| Weighted residual factors for significantly intense reflections | 0.1037 |
| Weighted residual factors for all reflections included in the refinement | 0.1169 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.036 |
| 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 |
|---|---|---|---|
| 178734 (current) | 2016-03-21 | cif/4/08/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/08/45. |
4084546.cif |
| 140221 | 2015-07-05 | cif/ Updating files of 4084545, 4084546, 4084547, 4084548, 4084549, 4084550, 4084551, 4084552, 4084553, 4084554, 4084555, 4084556, 4084557, 4084558, 4084559 Original log message: Adding full bibliography for 4084545--4084559.cif. |
4084546.cif |
| 125785 | 2014-10-23 | cif/ Adding structures of 4084545, 4084546, 4084547, 4084548, 4084549, 4084550, 4084551, 4084552, 4084553, 4084554, 4084555, 4084556, 4084557, 4084558, 4084559 via cif-deposit CGI script. |
4084546.cif |
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Users of the data should acknowledge the original authors of the
structural data.