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Information card for entry 4088684
Preview
| Coordinates | 4088684.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C36 H41 Li O2 Zr |
|---|---|
| Calculated formula | C36 H41 Li O2 Zr |
| Title of publication | Zirconium and Hafnium Permethylpentalene Compounds |
| Authors of publication | Chadwick, F. Mark; Cooper, Robert T.; O’Hare, Dermot |
| Journal of publication | Organometallics |
| Year of publication | 2016 |
| Journal volume | 35 |
| Journal issue | 12 |
| Pages of publication | 2092 |
| a | 9.9544 ± 0.0002 Å |
| b | 9.9584 ± 0.0002 Å |
| c | 17.9494 ± 0.0005 Å |
| α | 74.4529 ± 0.0009° |
| β | 80.4795 ± 0.0008° |
| γ | 64.7984 ± 0.0009° |
| Cell volume | 1548.36 ± 0.06 Å3 |
| Cell temperature | 150 K |
| Ambient diffraction temperature | 150 K |
| Number of distinct elements | 5 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0453 |
| Residual factor for significantly intense reflections | 0.0387 |
| Weighted residual factors for all reflections | 0.0907 |
| Weighted residual factors for significantly intense reflections | 0.0871 |
| Weighted residual factors for all reflections included in the refinement | 0.0907 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.9006 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 237762 (current) | 2019-11-24 | cif/ Adding structures of 4088679, 4088680, 4088681, 4088682, 4088683, 4088684, 4088685, 4088686 via cif-deposit CGI script. |
4088684.cif |
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Users of the data should acknowledge the original authors of the
structural data.