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Information card for entry 4087915
Preview
| Coordinates | 4087915.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C77 H53 B Cl2 F30 Ir N4 O4 S2 |
|---|---|
| Calculated formula | C77 H53 B Cl2 F30 Ir N4 O4 S2 |
| Title of publication | Sequential Nitrene Transfers to an Organometallic Half-Sandwich Iridium Complex |
| Authors of publication | Turlington, Christopher R.; White, Peter S.; Brookhart, Maurice; Templeton, Joseph L. |
| Journal of publication | Organometallics |
| Year of publication | 2015 |
| Journal volume | 34 |
| Journal issue | 20 |
| Pages of publication | 4810 |
| a | 24.7042 ± 0.0004 Å |
| b | 17.9764 ± 0.0003 Å |
| c | 18.7177 ± 0.0003 Å |
| α | 90° |
| β | 109.295 ± 0.0006° |
| γ | 90° |
| Cell volume | 7845.5 ± 0.2 Å3 |
| Cell temperature | 100 K |
| Ambient diffraction temperature | 100 K |
| Number of distinct elements | 9 |
| 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 | 0.0534 |
| Residual factor for significantly intense reflections | 0.0517 |
| Weighted residual factors for significantly intense reflections | 0.1227 |
| Weighted residual factors for all reflections included in the refinement | 0.1237 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.249 |
| Diffraction radiation wavelength | 1.54178 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 237119 (current) | 2019-11-24 | cif/ Adding structures of 4087915 via cif-deposit CGI script. |
4087915.cif |
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