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Information card for entry 2202534
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| Coordinates | 2202534.cif |
|---|---|
| Structure factors | 2202534.hkl |
| Original IUCr paper | HTML |
| Formula | C6 H14 Cl4 Co N2 |
|---|---|
| Calculated formula | C6 H14 Cl4 Co N2 |
| SMILES | [Co](Cl)(Cl)([Cl-])[Cl-].[NH+]12CC[NH+](CC1)CC2 |
| Title of publication | 1,4-Diazoniabicyclo[2.2.2]octane tetrachlorocobaltate |
| Authors of publication | Bremner, Colin A.; Harrison, William T. A. |
| Journal of publication | Acta Crystallographica Section E |
| Year of publication | 2003 |
| Journal volume | 59 |
| Journal issue | 7 |
| Pages of publication | m425 - m426 |
| a | 9.4875 ± 0.0002 Å |
| b | 6.7174 ± 0.0002 Å |
| c | 18.3121 ± 0.0005 Å |
| α | 90° |
| β | 92.842 ± 0.0001° |
| γ | 90° |
| Cell volume | 1165.62 ± 0.05 Å3 |
| Cell temperature | 120 ± 2 K |
| Ambient diffraction temperature | 120 ± 2 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 | 0.0399 |
| Residual factor for significantly intense reflections | 0.0324 |
| Weighted residual factors for significantly intense reflections | 0.075 |
| Weighted residual factors for all reflections included in the refinement | 0.0784 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.055 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
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Users of the data should acknowledge the original authors of the
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