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Information card for entry 4089141
Preview
| Coordinates | 4089141.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Formula | C18 H12 Br F3 Ge |
|---|---|
| Calculated formula | C18 H12 Br F3 Ge |
| SMILES | [Ge](Br)(c1ccc(F)cc1)(c1ccc(F)cc1)c1ccc(F)cc1 |
| Title of publication | Oligogermanes Containing Only Electron-Withdrawing Substituents: Synthesis and Properties |
| Authors of publication | Zaitsev, Kirill V.; Lam, Kevin; Zhanabil, Zhaisan; Suleimen, Yerlan; Kharcheva, Anastasia V.; Tafeenko, Viktor A.; Oprunenko, Yuri F.; Poleshchuk, Oleg Kh.; Lermontova, Elmira Kh.; Churakov, Andrei V. |
| Journal of publication | Organometallics |
| Year of publication | 2016 |
| Journal volume | 36 |
| Journal issue | 2 |
| Pages of publication | 298 |
| a | 10.4984 ± 0.0005 Å |
| b | 11.4856 ± 0.0006 Å |
| c | 14.0151 ± 0.0006 Å |
| α | 90° |
| β | 91.27 ± 0.01° |
| γ | 90° |
| Cell volume | 1689.53 ± 0.14 Å3 |
| Cell temperature | 295 ± 2 K |
| Ambient diffraction temperature | 295 K |
| Number of distinct elements | 5 |
| 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 | 0.062 |
| Residual factor for significantly intense reflections | 0.0522 |
| Weighted residual factors for significantly intense reflections | 0.1429 |
| Weighted residual factors for all reflections included in the refinement | 0.1533 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.014 |
| Diffraction radiation wavelength | 1.54186 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301831 (current) | 2025-08-20 | Add cross-references to PubChem compounds in COD range 4/08/ Each referenced PubChem compound corresponds to the full crystal structure. |
4089141.cif |
| 238009 | 2019-11-24 | cif/ Adding structures of 4089140, 4089141, 4089142, 4089143, 4089144, 4089145, 4089146 via cif-deposit CGI script. |
4089141.cif |
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Users of the data should acknowledge the original authors of the
structural data.