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Information card for entry 1577286
Preview
| Coordinates | 1577286.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Common name | 2,3,6,7,9,10-Me6-9,10-DHDBA |
|---|---|
| Chemical name | 2 |
| Formula | C18 H22 B2 |
| Calculated formula | C18 H22 B2 |
| Title of publication | Zerovalent transition-metal inverse-sandwich complexes of a diborataanthracene dianion |
| Authors of publication | Gerstner, Alexander; Arrowsmith, Merle; Dietz, Maximilian; Mihm, Cornelius; Braunschweig, Holger |
| Journal of publication | Chemical Science |
| Year of publication | 2026 |
| a | 8.3196 ± 0.0003 Å |
| b | 9.7359 ± 0.0003 Å |
| c | 10.7962 ± 0.0003 Å |
| α | 69.942 ± 0.003° |
| β | 75.684 ± 0.003° |
| γ | 66.726 ± 0.003° |
| Cell volume | 748.24 ± 0.05 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 3 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0708 |
| Residual factor for significantly intense reflections | 0.0562 |
| Weighted residual factors for significantly intense reflections | 0.1644 |
| Weighted residual factors for all reflections included in the refinement | 0.1852 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.108 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 1.54184 Å |
| Diffraction radiation type | CuKα |
| Diffraction radiation X-ray symbol | K-L~2,3~ |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 306070 (current) | 2026-05-22 | cif/ Adding structures of 1577285, 1577286, 1577287, 1577288, 1577289, 1577290, 1577291, 1577292, 1577293 via cif-deposit CGI script. |
1577286.cif |
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Users of the data should acknowledge the original authors of the
structural data.