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Information card for entry 2012008
Preview
| Coordinates | 2012008.cif |
|---|---|
| Structure factors | 2012008.hkl |
| Original IUCr paper | HTML |
| Chemical name | Bis(hydridotris-{3-cyclohexylpyrazol-1-yl}borato)copper(II) bis(dichloromethane) solvate |
|---|---|
| Formula | C56 H84 B2 Cl4 Cu N12 |
| Calculated formula | C56 H84 B2 Cl4 Cu N12 |
| Title of publication | Bis[tris(3-cyclohexylpyrazol-1-yl)hydridoborato]copper(II) dichloromethane disolvate |
| Authors of publication | Halcrow, Malcolm A.; Kilner, Colin A.; Thornton-Pett, Mark |
| Journal of publication | Acta Crystallographica Section C |
| Year of publication | 2001 |
| Journal volume | 57 |
| Journal issue | 6 |
| Pages of publication | 711 - 713 |
| a | 13.0758 ± 0.0002 Å |
| b | 18.3961 ± 0.0003 Å |
| c | 13.0405 ± 0.0002 Å |
| α | 90° |
| β | 104.694 ± 0.0012° |
| γ | 90° |
| Cell volume | 3034.22 ± 0.08 Å3 |
| Cell temperature | 150 ± 2 K |
| Ambient diffraction temperature | 150 ± 2 K |
| Number of distinct elements | 6 |
| 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 | 0.0722 |
| Residual factor for significantly intense reflections | 0.0578 |
| Weighted residual factors for all reflections included in the refinement | 0.1726 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.037 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | Yes |
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