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Information card for entry 7709067
Preview
| Coordinates | 7709067.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Chemical name | (1,1,2,2,2,3-hexacarbonyl)-(1-?5-cyclopentadienyl)-?3-[1,2-?1,?1,3-?2-(phenyl)ethenylidene]-(tri-ethyl phosphite-3κP)–rhenium–iron–platinum(Fe–Re, Fe–Pt) |
|---|---|
| Formula | C25 H26 Fe O9 P Pt Re |
| Calculated formula | C25 H26 Fe O9 P Pt Re |
| SMILES | [Pt]12(C#[O])([Fe]3([Re]4567([C]13=[CH]2c1ccccc1)(C#[O])(C#[O])[cH]1[cH]4[cH]5[c]6[cH]71)(C#[O])(C#[O])C#[O])[P](OCC)(OCC)OCC |
| Title of publication | Trinuclear ReFePt clusters with a μ<sub>3</sub>-phenylvinylidene ligand: synthetic approaches, rearrangement of vinylidene, and redox-induced transformations. |
| Authors of publication | Verpekin, Victor V.; Chudin, Oleg S.; Vasiliev, Alexander D.; Kondrasenko, Alexander A.; Shor, Aleksey M.; Burmakina, Galina V.; Zimonin, Dmitry V.; Maksimov, Nikolai G.; Rubaylo, Anatoly I. |
| Journal of publication | Dalton transactions (Cambridge, England : 2003) |
| Year of publication | 2021 |
| Journal volume | 51 |
| Journal issue | 1 |
| Pages of publication | 324 - 339 |
| a | 9.4887 ± 0.0003 Å |
| b | 9.8037 ± 0.0003 Å |
| c | 16.3209 ± 0.0005 Å |
| α | 84.437 ± 0.001° |
| β | 83.024 ± 0.001° |
| γ | 74.776 ± 0.001° |
| Cell volume | 1450.76 ± 0.08 Å3 |
| Cell temperature | 296 ± 2 K |
| Ambient diffraction temperature | 296 ± 2 K |
| Number of distinct elements | 7 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0625 |
| Residual factor for significantly intense reflections | 0.0441 |
| Weighted residual factors for significantly intense reflections | 0.1026 |
| Weighted residual factors for all reflections included in the refinement | 0.113 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.954 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 272642 (current) | 2022-02-04 | cif/ Updating files of 7709067, 7709068 Original log message: Adding full bibliography for 7709067--7709068.cif. |
7709067.cif |
| 271370 | 2021-12-14 | cif/ Adding structures of 7709067, 7709068 via cif-deposit CGI script. |
7709067.cif |
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