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Information card for entry 7712747
Preview
| Coordinates | 7712747.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C51.75 H80 N7 Sc Si2 |
|---|---|
| Calculated formula | C43 H70 N7 Sc Si2 |
| Title of publication | Group 3 dialkyl complexes of a rigid monoanionic NNN-donor pincer ligand: synthesis, structures, unexpected reactivity with CPh<sub>3</sub><sup>+</sup>, and hydroamination catalysis. |
| Authors of publication | Vasanthakumar, Aathith; Gray, Novan A. G.; Franko, Christopher J.; Murphy, Maia C.; Emslie, David J. H. |
| Journal of publication | Dalton transactions (Cambridge, England : 2003) |
| Year of publication | 2023 |
| a | 14.651 ± 0.006 Å |
| b | 16.119 ± 0.008 Å |
| c | 25.584 ± 0.01 Å |
| α | 94.046 ± 0.011° |
| β | 93.705 ± 0.009° |
| γ | 110.899 ± 0.01° |
| Cell volume | 5604 ± 4 Å3 |
| Cell temperature | 100 K |
| Ambient diffraction temperature | 100 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 | 0.0961 |
| Residual factor for significantly intense reflections | 0.0588 |
| Weighted residual factors for significantly intense reflections | 0.1385 |
| Weighted residual factors for all reflections included in the refinement | 0.156 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.027 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
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