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Information card for entry 1558171
Preview
| Coordinates | 1558171.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C13 H13 Bi S2 |
|---|---|
| Calculated formula | C13 H13 Bi S2 |
| Title of publication | Methylbismuth: an Organometallic Bismuthinidene Biradical |
| Authors of publication | Mukhopadhyay, Deb Pratim; Schleier, Domenik; Wirsing, Sara; Ramler, Jacqueline; Kaiser, Dustin; Reusch, Engelbert; Hemberger, Patrick; Preitschopf, Tobias; Krummenacher, Ivo; Engels, Bernd; Fischer, Ingo; Lichtenberg, Crispin |
| Journal of publication | Chemical Science |
| Year of publication | 2020 |
| a | 4.0972 ± 0.0012 Å |
| b | 10.591 ± 0.003 Å |
| c | 16.59 ± 0.005 Å |
| α | 108.6 ± 0.004° |
| β | 94.491 ± 0.004° |
| γ | 90.019 ± 0.004° |
| Cell volume | 680 ± 0.3 Å3 |
| Cell temperature | 100 K |
| Ambient diffraction temperature | 100 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 | 0.0293 |
| Residual factor for significantly intense reflections | 0.0243 |
| Weighted residual factors for significantly intense reflections | 0.0525 |
| Weighted residual factors for all reflections included in the refinement | 0.054 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.08 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 252619 (current) | 2020-06-04 | cif/ Adding structures of 1558171 via cif-deposit CGI script. |
1558171.cif |
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Users of the data should acknowledge the original authors of the
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