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Information card for entry 4516671
Preview
| Coordinates | 4516671.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C34 H25 B Cu F4 N4 O3 P |
|---|---|
| Calculated formula | C34 H25 B Cu F4 N4 O3 P |
| Title of publication | [Copper(phenanthroline)(bisisonitrile)]±Complexes for the Visible-Light-Mediated Atom Transfer Radical Addition and Allylation Reactions |
| Authors of publication | Knorn, Matthias; Rawner, Thomas; Czerwieniec, Rafał; Reiser, Oliver |
| Journal of publication | ACS Catalysis |
| Year of publication | 2015 |
| Journal volume | 5 |
| Journal issue | 9 |
| Pages of publication | 5186 |
| a | 12.5021 ± 0.0003 Å |
| b | 13.6073 ± 0.0003 Å |
| c | 19.1227 ± 0.0004 Å |
| α | 90° |
| β | 108.373 ± 0.002° |
| γ | 90° |
| Cell volume | 3087.32 ± 0.12 Å3 |
| Cell temperature | 123 ± 1 K |
| Ambient diffraction temperature | 123 ± 1 K |
| Number of distinct elements | 8 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/n 1 |
| Hall space group symbol | -P 2yn |
| Residual factor for all reflections | 0.0437 |
| Residual factor for significantly intense reflections | 0.036 |
| Weighted residual factors for significantly intense reflections | 0.0852 |
| Weighted residual factors for all reflections included in the refinement | 0.0894 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.06 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 239440 (current) | 2019-11-24 | cif/ Adding structures of 4516671 via cif-deposit CGI script. |
4516671.cif |
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