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Information card for entry 4088778
Preview
| Coordinates | 4088778.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C29 H17 B Cl2 F10 Zr |
|---|---|
| Calculated formula | C29 H17 B Cl2 F10 Zr |
| Title of publication | Borata-Alkene Derived Syntheses of (F5C6)2B-Substituted Bis(indenyl) Group 4 Metal Complexes |
| Authors of publication | Kohrt, Sonja; Kehr, Gerald; Daniliuc, Constantin G.; Rojas, René S.; Rieger, Bernhard; Troll, Carsten; Erker, Gerhard |
| Journal of publication | Organometallics |
| Year of publication | 2016 |
| Journal volume | 35 |
| Journal issue | 16 |
| Pages of publication | 2689 |
| a | 11.6443 ± 0.0002 Å |
| b | 20.1078 ± 0.0003 Å |
| c | 12.1775 ± 0.0003 Å |
| α | 90° |
| β | 98.686 ± 0.001° |
| γ | 90° |
| Cell volume | 2818.55 ± 0.09 Å3 |
| Cell temperature | 223 ± 2 K |
| Ambient diffraction temperature | 223 ± 2 K |
| Number of distinct elements | 6 |
| 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 | 0.041 |
| Residual factor for significantly intense reflections | 0.0333 |
| Weighted residual factors for significantly intense reflections | 0.069 |
| Weighted residual factors for all reflections included in the refinement | 0.0742 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.06 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 237826 (current) | 2019-11-24 | cif/ Adding structures of 4088777, 4088778, 4088779 via cif-deposit CGI script. |
4088778.cif |
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Users of the data should acknowledge the original authors of the
structural data.