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CIF Information Card
Information card for 7101898
7101897 << 7101898 >> 7101899Preview
|
Coordinates |
7101898.cif |
Structure parameters
| Common name | 060036 |
| Formula | - C11 H23 F6 Fe N3 O6 S2 - |
| Calculated formula | - C11 H23 F6 Fe N3 O6 S2 - |
| Title of publication | Non-heme iron(II) complexes are efficient olefin aziridination catalysts. |
| Authors of publication | Klotz, Katie L; Slominski, Luke M; Hull, Anthony V; Gottsacker, Victoria M; Mas-Ballesté, Rubén; Que, Jr, Lawrence; Halfen, Jason A |
| Journal of publication | Chemical communications (Cambridge, England) |
| Year of publication | 2007 |
| Journal issue | 20 |
| Pages of publication | 2063 - 2065 |
| a | 13.313 ± 0.002 Å |
| b | 10.946 ± 0.002 Å |
| c | 15.148 ± 0.003 Å |
| α | 90° |
| β | 110.86 ± 0.02° |
| γ | 90° |
| Cell volume | 2062.7 ± 0.6 Å3 |
| Cell temperature | 173 ± 2 K |
| Ambient diffraction temperature | 173 ± 2 K |
| Number of distinct elements | 7 |
| Hermann-Mauguin symmetry space group | C 1 c 1 |
| Hall symmetry space group | C -2yc |
| Residual factor for all reflections | 0.0435 |
| Residual factor for observed reflections | 0.042 |
| Weighted residual factors for the observed reflections | 0.1056 |
| Weighted residual factors for all reflections included in the refinement | 0.1075 |
| Goodness-of-fit parameter for observed reflections | 1.031 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |