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Information card for entry 1559028
Preview
| Coordinates | 1559028.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Chemical name | [ReH8BBN4][K(18c6)(DME)] |
|---|---|
| Formula | C48 H98.03 B4 K O8 Re |
| Calculated formula | C48 H98.042 B4 K O8 Re |
| Title of publication | Synthesis and structures of anionic rhenium polyhydride complexes of boron‒hydride ligands and their application in catalysis |
| Authors of publication | Donnelly, Liam J.; Parsons, Simon; Morrison, Carole A.; Thomas, Stephen P.; Love, Jason B. |
| Journal of publication | Chemical Science |
| Year of publication | 2020 |
| a | 11.2627 ± 0.0002 Å |
| b | 15.9727 ± 0.0003 Å |
| c | 16.0123 ± 0.0002 Å |
| α | 96.714 ± 0.001° |
| β | 91.29 ± 0.001° |
| γ | 102.351 ± 0.002° |
| Cell volume | 2791.22 ± 0.08 Å3 |
| Cell temperature | 220 ± 2 K |
| Ambient diffraction temperature | 220 K |
| Number of distinct elements | 6 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0282 |
| Residual factor for significantly intense reflections | 0.0227 |
| Weighted residual factors for significantly intense reflections | 0.0444 |
| Weighted residual factors for all reflections included in the refinement | 0.0461 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.039 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 256286 (current) | 2020-09-10 | cif/ Adding structures of 1559028, 1559029 via cif-deposit CGI script. |
1559028.cif |
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