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Information card for entry 1100827
Preview
| Coordinates | 1100827.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C23 H35 Y |
|---|---|
| Calculated formula | C23 H35 Y |
| Title of publication | Metallocene Allyl Reactivity in the Presence of Alkenes Tethered to Cyclopentadienyl Ligands |
| Authors of publication | Evans, William J.; Kozimor, Stosh A.; Brady, Jason C.; Davis, Benjamin L.; Nyce, Gregory W.; Seibel, Christopher A.; Ziller, Joseph W.; Doedens, Robert J. |
| Journal of publication | Organometallics |
| Year of publication | 2005 |
| Journal volume | 24 |
| Journal issue | 10 |
| Pages of publication | 2269 - 2278 |
| a | 8.9218 ± 0.0011 Å |
| b | 17.632 ± 0.002 Å |
| c | 13.6181 ± 0.0017 Å |
| α | 90° |
| β | 90.066 ± 0.002° |
| γ | 90° |
| Cell volume | 2142.3 ± 0.5 Å3 |
| Cell temperature | 163 ± 2 K |
| Ambient diffraction temperature | 163 ± 2 K |
| Number of distinct elements | 3 |
| 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 | 0.0499 |
| Residual factor for significantly intense reflections | 0.0304 |
| Weighted residual factors for significantly intense reflections | 0.0671 |
| Weighted residual factors for all reflections included in the refinement | 0.0732 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.056 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
Version history
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Users of the data should acknowledge the original authors of the
structural data.