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Information card for entry 4130241
Preview
| Coordinates | 4130241.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C34 H44 N2 U |
|---|---|
| Calculated formula | C34 H44 N2 U |
| Title of publication | Influence of the 5f Orbitals on the Bonding and Reactivity in Organoactinides: Experimental and Computational Studies on a Uranium Metallacyclopropene. |
| Authors of publication | Zhang, Lei; Hou, Guohua; Zi, Guofu; Ding, Wanjian; Walter, Marc D. |
| Journal of publication | Journal of the American Chemical Society |
| Year of publication | 2016 |
| Journal volume | 138 |
| Journal issue | 15 |
| Pages of publication | 5130 - 5142 |
| a | 10.2536 ± 0.0017 Å |
| b | 14.957 ± 0.003 Å |
| c | 20.016 ± 0.003 Å |
| α | 90° |
| β | 95.213 ± 0.003° |
| γ | 90° |
| Cell volume | 3057 ± 0.9 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 4 |
| 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 | 0.0585 |
| Residual factor for significantly intense reflections | 0.0332 |
| Weighted residual factors for significantly intense reflections | 0.0623 |
| Weighted residual factors for all reflections included in the refinement | 0.0693 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.97 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 240743 (current) | 2019-11-25 | cif/ Adding structures of 4130232, 4130233, 4130234, 4130235, 4130236, 4130237, 4130238, 4130239, 4130240, 4130241 via cif-deposit CGI script. |
4130241.cif |
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Users of the data should acknowledge the original authors of the
structural data.