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Information card for entry 4088724
Preview
| Coordinates | 4088724.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C21 H23 F3 Fe2 O5 S2 |
|---|---|
| Calculated formula | C21 H23 F3 Fe2 O5 S2 |
| Title of publication | Photochemical Alkyne Insertions into the Iron‒Thiocarbonyl Bond of [Fe2(CS)(CO)3(Cp)2] |
| Authors of publication | Marchetti, Fabio; Zacchini, Stefano; Zanotti, Valerio |
| Journal of publication | Organometallics |
| Year of publication | 2016 |
| Journal volume | 35 |
| Journal issue | 16 |
| Pages of publication | 2630 |
| a | 17.733 ± 0.004 Å |
| b | 14.481 ± 0.003 Å |
| c | 19.052 ± 0.004 Å |
| α | 90° |
| β | 98.39 ± 0.03° |
| γ | 90° |
| Cell volume | 4840 ± 1.8 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/n 1 |
| Hall space group symbol | -P 2yn |
| Residual factor for all reflections | 0.1413 |
| Residual factor for significantly intense reflections | 0.0876 |
| Weighted residual factors for significantly intense reflections | 0.2261 |
| Weighted residual factors for all reflections included in the refinement | 0.2659 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.044 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 237788 (current) | 2019-11-24 | cif/ Adding structures of 4088722, 4088723, 4088724 via cif-deposit CGI script. |
4088724.cif |
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Users of the data should acknowledge the original authors of the
structural data.