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Information card for entry 2010612
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| Coordinates | 2010612.cif |
|---|---|
| Structure factors | 2010612.hkl |
| Original IUCr paper | HTML |
| Chemical name | (iodobromo)triphenylarsenic |
|---|---|
| Formula | C18 H15 As Br I |
| Calculated formula | C18 H15 As Br I |
| SMILES | Br[I][As](c1ccccc1)(c1ccccc1)c1ccccc1 |
| Title of publication | (Triphenylarsine)iodinemonobromine: a charge-transfer adduct in which arsenic selectively bonds to iodine |
| Authors of publication | Cross, Wendy I.; Dahalan, Mohjat Z.; Godfrey, Stephen M.; Jaiboon, Nongnuch; McAuliffe, Charles A.; Pritchard, Robin G.; Thompson, Graeme M. |
| Journal of publication | Acta Crystallographica Section C |
| Year of publication | 2000 |
| Journal volume | 56 |
| Journal issue | 2 |
| Pages of publication | 140 - 141 |
| a | 9.1198 ± 0.0013 Å |
| b | 9.96 ± 0.002 Å |
| c | 19.483 ± 0.003 Å |
| α | 90° |
| β | 92.176 ± 0.012° |
| γ | 90° |
| Cell volume | 1768.4 ± 0.5 Å3 |
| Cell temperature | 203 ± 2 K |
| Ambient diffraction temperature | 203 ± 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 | 0.053 |
| Residual factor for significantly intense reflections | 0.036 |
| Weighted residual factors for all reflections included in the refinement | 0.089 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.023 |
| 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
structural data.