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Information card for entry 7042720
Preview
| Coordinates | 7042720.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C20 H30 Bi Br |
|---|---|
| Calculated formula | C20 H30 Bi Br |
| SMILES | [Bi](Br)(C1C2CC3CC(CC1C3)C2)C1C2CC3CC(CC1C3)C2 |
| Title of publication | Adamantyl Metal Complexes: New Routes to Adamantyl Anions and New Transmetallations |
| Authors of publication | Armstrong, David; Taullaj, Fioralba; Singh, Kamalpreet; Mirabi, Bijan; Lough, Alan; Fekl, Ulrich Werner |
| Journal of publication | Dalton Trans. |
| Year of publication | 2017 |
| a | 25.362 ± 0.002 Å |
| b | 6.4647 ± 0.0005 Å |
| c | 21.7366 ± 0.0016 Å |
| α | 90° |
| β | 93.377 ± 0.003° |
| γ | 90° |
| Cell volume | 3557.7 ± 0.5 Å3 |
| Cell temperature | 147 ± 2 K |
| Ambient diffraction temperature | 147 ± 2 K |
| Number of distinct elements | 4 |
| Space group number | 15 |
| Hermann-Mauguin space group symbol | C 1 2/c 1 |
| Hall space group symbol | -C 2yc |
| Residual factor for all reflections | 0.0456 |
| Residual factor for significantly intense reflections | 0.0284 |
| Weighted residual factors for significantly intense reflections | 0.0543 |
| Weighted residual factors for all reflections included in the refinement | 0.0588 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.044 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 195612 (current) | 2017-04-20 | cif/ Adding structures of 7042720, 7042721, 7042722, 7042723, 7042724 via cif-deposit CGI script. |
7042720.cif |
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