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Information card for entry 4349523
Preview
| Coordinates | 4349523.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Chemical name | [Diethyl-(2,2-dimethyl-1-(tert-butyl-(1-(pyridine-2-yl)ethoxy)amino)propyl) phosphonate-N,O]bis(1,1,1,5,5,5-hexafluoropentane-2,4-dionato)copper |
|---|---|
| Formula | C30 H39 Cu F12 N2 O8 P |
| Calculated formula | C30 H39 Cu F12 N2 O8 P |
| Title of publication | C–ON bond homolysis of alkoxyamines triggered by paramagnetic copper(ii) salts |
| Authors of publication | Audran, Gérard; Bagryanskaya, Elena; Bagryanskaya, Irina; Brémond, Paul; Edeleva, Mariya; Marque, Sylvain R. A.; Parkhomenko, Dmitriy; Tretyakov, Evgeny; Zhivetyeva, Svetlana |
| Journal of publication | Inorganic Chemistry Frontiers |
| Year of publication | 2016 |
| Journal volume | 3 |
| Journal issue | 11 |
| Pages of publication | 1464 |
| a | 9.5604 ± 0.0002 Å |
| b | 19.9209 ± 0.0006 Å |
| c | 20.718 ± 0.0006 Å |
| α | 90° |
| β | 96.103 ± 0.001° |
| γ | 90° |
| Cell volume | 3923.42 ± 0.18 Å3 |
| Cell temperature | 200 ± 2 K |
| Ambient diffraction temperature | 200 ± 2 K |
| Number of distinct elements | 7 |
| 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 | 0.0825 |
| Residual factor for significantly intense reflections | 0.0582 |
| Weighted residual factors for significantly intense reflections | 0.1591 |
| Weighted residual factors for all reflections included in the refinement | 0.1851 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.08 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301840 (current) | 2025-08-21 | Add cross-references to PubChem compounds in COD range 4/34/ Each referenced PubChem compound corresponds to the full crystal structure. |
4349523.cif |
| 234851 | 2019-11-23 | cif/ Adding structures of 4349520, 4349521, 4349522, 4349523 via cif-deposit CGI script. |
4349523.cif |
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Users of the data should acknowledge the original authors of the
structural data.