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Information card for entry 4087643
Preview
| Coordinates | 4087643.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C47 H72 N2 O Th |
|---|---|
| Calculated formula | C47 H72 N2 O Th |
| Title of publication | Small Molecule Activation Mediated by a Thorium Terminal Imido Metallocene |
| Authors of publication | Zhou, Enwei; Ren, Wenshan; Hou, Guohua; Zi, Guofu; Fang, De-Cai; Walter, Marc D. |
| Journal of publication | Organometallics |
| Year of publication | 2015 |
| Journal volume | 34 |
| Journal issue | 14 |
| Pages of publication | 3637 |
| a | 10.681 ± 0.003 Å |
| b | 20.702 ± 0.006 Å |
| c | 20.516 ± 0.006 Å |
| α | 90° |
| β | 101.729 ± 0.006° |
| γ | 90° |
| Cell volume | 4442 ± 2 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/c 1 |
| Hall space group symbol | -P 2ybc |
| Residual factor for all reflections | 0.0436 |
| Residual factor for significantly intense reflections | 0.0313 |
| Weighted residual factors for significantly intense reflections | 0.0656 |
| Weighted residual factors for all reflections included in the refinement | 0.0698 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.033 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 236896 (current) | 2019-11-24 | cif/ Adding structures of 4087641, 4087642, 4087643, 4087644, 4087645, 4087646, 4087647, 4087648, 4087649 via cif-deposit CGI script. |
4087643.cif |
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Users of the data should acknowledge the original authors of the
structural data.