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Information card for entry 2010666
Preview
| Coordinates | 2010666.cif |
|---|---|
| Structure factors | 2010666.hkl |
| Original IUCr paper | HTML |
| Formula | C7 H15 Br2 N O Sn |
|---|---|
| Calculated formula | C7 H15 Br2 N O Sn |
| SMILES | [Sn](Br)(Br)(C)(C)[O]=C1CCCN1C |
| Title of publication | A 1:1 adduct between dimethyltin dibromide and <i>N</i>-methylpyrrolidinone (NMP) |
| Authors of publication | König, Uwe-Christoph; Berkei, Michael; Neikes, Frank; Preut, Hans; Mitchell, Terence Nigel |
| Journal of publication | Acta Crystallographica Section C |
| Year of publication | 2000 |
| Journal volume | 56 |
| Journal issue | 2 |
| Pages of publication | e53 - e54 |
| a | 10.652 ± 0.001 Å |
| b | 7.002 ± 0.001 Å |
| c | 16.427 ± 0.001 Å |
| α | 90° |
| β | 93.36 ± 0.01° |
| γ | 90° |
| Cell volume | 1223.1 ± 0.2 Å3 |
| Cell temperature | 173 ± 2 K |
| Ambient diffraction temperature | 173 ± 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 | 0.029 |
| Residual factor for significantly intense reflections | 0.024 |
| Weighted residual factors for all reflections included in the refinement | 0.059 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.049 |
| Diffraction radiation wavelength | 0.71069 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
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