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Information card for entry 2102018
Preview
| Coordinates | 2102018.cif |
|---|---|
| Original IUCr paper | HTML |
| Formula | C39.5 H64 Cs2 P2 |
|---|---|
| Calculated formula | C39.5 H64 Cs2 P2 |
| Title of publication | Two phases of {[CsPH(η^6^-2,4,6-<i>^t^</i>Bu~3~C~6~H~2~)]~2~(η^3^-toluene)~0.5~}~<i>x~</i>: their structures and interconversions |
| Authors of publication | Rheingold, A. L.; Concolino, T. E.; Lam, K.-C.; Guzei, I. A.; Rabe, G. W.; Heise, H. |
| Journal of publication | Acta Crystallographica Section B |
| Year of publication | 2000 |
| Journal volume | 56 |
| Journal issue | 2 |
| Pages of publication | 210 - 214 |
| a | 14.6241 ± 0.0003 Å |
| b | 14.7393 ± 0.0003 Å |
| c | 22.072 ± 0.0004 Å |
| α | 72.2117 ± 0.0007° |
| β | 73.3659 ± 0.0008° |
| γ | 70.2953 ± 0.0007° |
| Cell volume | 4174.81 ± 0.14 Å3 |
| Cell temperature | 173 ± 2 K |
| Ambient diffraction temperature | 173 ± 2 K |
| Number of distinct elements | 4 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0517 |
| Residual factor for significantly intense reflections | 0.0405 |
| Weighted residual factors for all reflections included in the refinement | 0.1486 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.173 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
Version history
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Users of the data should acknowledge the original authors of the
structural data.