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Information card for entry 7702123
Preview
| Coordinates | 7702123.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C24 H54 B18 N2 |
|---|---|
| Calculated formula | C24 H52.52 B18 N2 |
| Title of publication | Double deboronation and homometalation of 1,1'-bis(ortho-carborane). |
| Authors of publication | Thiripuranathar, Gobika; Chan, Antony P. Y.; Mandal, Dipendu; Man, Wing Y.; Argentari, Mario; Rosair, Georgina M.; Welch, Alan J. |
| Journal of publication | Dalton transactions (Cambridge, England : 2003) |
| Year of publication | 2017 |
| Journal volume | 46 |
| Journal issue | 6 |
| Pages of publication | 1811 - 1821 |
| a | 8.8436 ± 0.0012 Å |
| b | 10.5897 ± 0.0011 Å |
| c | 11.103 ± 0.002 Å |
| α | 116.225 ± 0.006° |
| β | 101.483 ± 0.007° |
| γ | 104.113 ± 0.005° |
| Cell volume | 846.5 ± 0.2 Å3 |
| Cell temperature | 100 K |
| Ambient diffraction temperature | 100.15 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 | 0.0773 |
| Residual factor for significantly intense reflections | 0.0495 |
| Weighted residual factors for significantly intense reflections | 0.1184 |
| Weighted residual factors for all reflections included in the refinement | 0.1328 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.026 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
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