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Information card for entry 7708509
Preview
| Coordinates | 7708509.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C39 H37 Br Mn N O3 P2 |
|---|---|
| Calculated formula | C39 H37 Br Mn N O3 P2 |
| Title of publication | Mn(i) phosphine-amino-phosphinites: a highly modular class of pincer complexes for enantioselective transfer hydrogenation of aryl-alkyl ketones |
| Authors of publication | Jayaprakash, Harikrishnan |
| Journal of publication | Dalton Transactions |
| Year of publication | 2021 |
| a | 10.5751 ± 0.0003 Å |
| b | 29.5477 ± 0.001 Å |
| c | 12.0766 ± 0.0004 Å |
| α | 90° |
| β | 108.748 ± 0.001° |
| γ | 90° |
| Cell volume | 3573.4 ± 0.2 Å3 |
| Cell temperature | 100 K |
| Ambient diffraction temperature | 100 K |
| Number of distinct elements | 7 |
| Space group number | 4 |
| Hermann-Mauguin space group symbol | P 1 21 1 |
| Hall space group symbol | P 2yb |
| Residual factor for all reflections | 0.0537 |
| Residual factor for significantly intense reflections | 0.0531 |
| Weighted residual factors for significantly intense reflections | 0.1296 |
| Weighted residual factors for all reflections included in the refinement | 0.1308 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.026 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 1.54178 Å |
| Diffraction radiation type | CuKα |
| Diffraction radiation X-ray symbol | K-L~3~ |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 269553 (current) | 2021-10-05 | cif/ Adding structures of 7708509 via cif-deposit CGI script. |
7708509.cif |
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