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Information card for entry 4088987
Preview
| Coordinates | 4088987.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C76 H86 B2 Cl8 Cu2 F8 Fe6 N6 S6 |
|---|---|
| Calculated formula | C76 H86 B2 Cl8 Cu2 F8 Fe6 N6 S6 |
| Title of publication | Generation and Oligomerization ofN-Ferrocenyl Ketenimines via Open-Shell Intermediates |
| Authors of publication | Kienz, Torben; Förster, Christoph; Heinze, Katja |
| Journal of publication | Organometallics |
| Year of publication | 2016 |
| Journal volume | 35 |
| Journal issue | 21 |
| Pages of publication | 3681 |
| a | 11.092 ± 0.003 Å |
| b | 15.327 ± 0.004 Å |
| c | 15.563 ± 0.004 Å |
| α | 60.772 ± 0.006° |
| β | 71.684 ± 0.006° |
| γ | 78.348 ± 0.006° |
| Cell volume | 2188.2 ± 1 Å3 |
| Cell temperature | 173 ± 2 K |
| Ambient diffraction temperature | 173 ± 2 K |
| Number of distinct elements | 9 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.2343 |
| Residual factor for significantly intense reflections | 0.0786 |
| Weighted residual factors for significantly intense reflections | 0.1278 |
| Weighted residual factors for all reflections included in the refinement | 0.1684 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.808 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 237913 (current) | 2019-11-24 | cif/ Adding structures of 4088987 via cif-deposit CGI script. |
4088987.cif |
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Users of the data should acknowledge the original authors of the
structural data.