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Information card for entry 4130098
Preview
| Coordinates | 4130098.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C23 H44 Ir N P2 |
|---|---|
| Calculated formula | C23 H44 Ir N P2 |
| Title of publication | Reductive Cleavage of CO2 by Metal-Ligand-Cooperation Mediated by an Iridium Pincer Complex. |
| Authors of publication | Feller, Moran; Gellrich, Urs; Anaby, Aviel; Diskin-Posner, Yael; Milstein, David |
| Journal of publication | Journal of the American Chemical Society |
| Year of publication | 2016 |
| Journal volume | 138 |
| Journal issue | 20 |
| Pages of publication | 6445 - 6454 |
| a | 11.527 ± 0.002 Å |
| b | 11.527 ± 0.002 Å |
| c | 9.5824 ± 0.0019 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 1273.2 ± 0.4 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 102 |
| Hermann-Mauguin space group symbol | P 42 n m |
| Hall space group symbol | P 4n -2n |
| Residual factor for all reflections | 0.0279 |
| Residual factor for significantly intense reflections | 0.0231 |
| Weighted residual factors for significantly intense reflections | 0.0447 |
| Weighted residual factors for all reflections included in the refinement | 0.0458 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.258 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 240674 (current) | 2019-11-25 | cif/ Adding structures of 4130098, 4130099, 4130100 via cif-deposit CGI script. |
4130098.cif |
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Users of the data should acknowledge the original authors of the
structural data.