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Information card for entry 1577291
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| Coordinates | 1577291.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Common name | {eta6,eta'6-[2,3,6,7,9,10-Me6-9,10-DHDBA]}{Mo(CO)3}2 |
|---|---|
| Chemical name | 2-Mo2 |
| Formula | C24 H22 B2 Mo2 O6 |
| Calculated formula | C24 H22 B2 Mo2 O6 |
| 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 | 8.4981 ± 0.0001 Å |
| b | 10.587 ± 0.0002 Å |
| c | 13.5435 ± 0.0002 Å |
| α | 90° |
| β | 101.946 ± 0.002° |
| γ | 90° |
| Cell volume | 1192.11 ± 0.03 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/n 1 |
| Hall space group symbol | -P 2yn |
| Residual factor for all reflections | 0.0305 |
| Residual factor for significantly intense reflections | 0.0276 |
| Weighted residual factors for significantly intense reflections | 0.0707 |
| Weighted residual factors for all reflections included in the refinement | 0.0724 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.089 |
| 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 |
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Users of the data should acknowledge the original authors of the
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