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Information card for entry 7117658
Preview
| Coordinates | 7117658.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C34 H11 B F20 S |
|---|---|
| Calculated formula | C34 H11 B F20 S |
| Title of publication | The molecular and electronic structures of a thioaroyl cation formed by borinium ion-mediated C[double bond, length as m-dash]S double bond cleavage of CS2 |
| Authors of publication | Yoshiaki Shoji; Naoki Tanaka; Daisuke Hashizume; Takanori Fukushima |
| Journal of publication | Chem.Commun. |
| Year of publication | 2015 |
| Journal volume | 51 |
| Pages of publication | 13342 |
| a | 13.4674 ± 0.0001 Å |
| b | 13.8265 ± 0.0001 Å |
| c | 17.2405 ± 0.0001 Å |
| α | 90° |
| β | 94.8693 ± 0.0004° |
| γ | 90° |
| Cell volume | 3198.72 ± 0.04 Å3 |
| Cell temperature | 90 K |
| Ambient diffraction temperature | 90 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 | 0.0486 |
| Residual factor for significantly intense reflections | 0.0177 |
| Weighted residual factors for all reflections included in the refinement | 0.0283 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.569 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 153735 (current) | 2015-08-27 | cif/ Adding structures of 7117657, 7117658 via cif-deposit CGI script. |
7117658.cif |
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