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Information card for entry 7715210
Preview
| Coordinates | 7715210.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C10 H36 B18 Co N |
|---|---|
| Calculated formula | C10 H36 B18 Co N |
| SMILES | [Co]12345678([C]9%10%11(CCC[N+](C)(C)C)[BH]%12%132[BH]2%148[BH]8%157[CH]739[BH]39%10[BH]%10%11%12[BH]%11%129[BH]873[BH]2%15%11[BH]%13%14%10%12)[CH]237[CH]891[BH]1%104[BH]4%115[BH]562[BH]263[BH]378[BH]79%10[BH]814[BH]%1152[BH]6378 |
| Title of publication | Synthetic routes to carbon substituted cobalt bis(dicarbollide) alkyl halides and aromatic amines along with closely related irregular pathways. |
| Authors of publication | Nekvinda, Jan; Bavol, Dmytro; Litecká, Miroslava; Tüzün, Ece Zeynep; Dušek, Michal; Grüner, Bohumír |
| Journal of publication | Dalton transactions (Cambridge, England : 2003) |
| Year of publication | 2024 |
| Journal volume | 53 |
| Journal issue | 13 |
| Pages of publication | 5816 - 5826 |
| a | 13.7657 ± 0.0003 Å |
| b | 11.6644 ± 0.0002 Å |
| c | 14.2364 ± 0.0003 Å |
| α | 90° |
| β | 94.582 ± 0.002° |
| γ | 90° |
| Cell volume | 2278.61 ± 0.08 Å3 |
| Cell temperature | 100 ± 0.1 K |
| Ambient diffraction temperature | 100 ± 0.1 K |
| Number of distinct elements | 5 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/c 1 |
| Hall space group symbol | -P 2ybc |
| Residual factor for all reflections | 0.0527 |
| Residual factor for significantly intense reflections | 0.0466 |
| Weighted residual factors for significantly intense reflections | 0.1225 |
| Weighted residual factors for all reflections included in the refinement | 0.1257 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.067 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 1.54184 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 290943 (current) | 2024-04-05 | cif/ Updating files of 7715207, 7715208, 7715209, 7715210, 7715211, 7715212 Original log message: Adding full bibliography for 7715207--7715212.cif. |
7715210.cif |
| 289920 | 2024-02-22 | cif/ Adding structures of 7715207, 7715208, 7715209, 7715210, 7715211, 7715212 via cif-deposit CGI script. |
7715210.cif |
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Users of the data should acknowledge the original authors of the
structural data.