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Information card for entry 2003887
Preview
| Coordinates | 2003887.cif |
|---|---|
| Original IUCr paper | HTML |
| Common name | [(H)N2-ethyl]CoCl~3~ |
|---|---|
| Chemical name | Trichloro [N-(2-benzimidazolylmethyl)ethylammonium-N']cobalt(II) |
| Formula | C10 H14 Cl3 Co N3 |
| Calculated formula | C10 H14 Cl3 Co N3 |
| SMILES | [Co](Cl)(Cl)(Cl)[n]1c2ccccc2[nH]c1C[NH2+]CC |
| Title of publication | Trichloro[(1<i>H</i>-benzimidazol-2-ylmethyl)(ethyl)ammonium-<i>N</i>^3^]cobalt(II) |
| Authors of publication | Cooley, J. A.; Kamaras, P.; Rapta, M.; Jameson, G. B. |
| Journal of publication | Acta Crystallographica Section C |
| Year of publication | 1995 |
| Journal volume | 51 |
| Journal issue | 9 |
| Pages of publication | 1811 - 1813 |
| a | 10.92 ± 0.001 Å |
| b | 16.409 ± 0.003 Å |
| c | 7.753 ± 0.006 Å |
| α | 90° |
| β | 93.89 ± 0.03° |
| γ | 90° |
| Cell volume | 1386 ± 1.1 Å3 |
| Cell temperature | 193 ± 2 K |
| Ambient diffraction temperature | 193 ± 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 | 0.0329 |
| Residual factor for significantly intense reflections | 0.03 |
| Weighted residual factors for all reflections | 0.0861 |
| Weighted residual factors for significantly intense reflections | 0.0817 |
| Goodness-of-fit parameter for all reflections | 1.046 |
| Goodness-of-fit parameter for significantly intense reflections | 1.058 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
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The link is: https://www.crystallography.net/2003887.html
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Users of the data should acknowledge the original authors of the
structural data.