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Information card for entry 4301141
Preview
| Coordinates | 4301141.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C40 H35 B Cu N3 |
|---|---|
| Calculated formula | C40 H35 B Cu N3 |
| SMILES | [Cu]1([n]2c3c4[n]1c(C)ccc4ccc3ccc2C)[N]#CC.c1c(cccc1)[B-](c1ccccc1)(c1ccccc1)c1ccccc1 |
| Title of publication | Strong Coordination of Tetraphenylborate Anion to Copper(I) Bipyridine and Phenanthroline-Based Complexes and Its Effect on Catalytic Activity in the Cyclopropanation of Styrene |
| Authors of publication | Carolynne Ricardo; Lauren M. Matosziuk; Jeffrey D. Evanseck; Tomislav Pintauer |
| Journal of publication | Inorganic Chemistry |
| Year of publication | 2009 |
| Journal volume | 48 |
| Pages of publication | 16 - 18 |
| a | 11.77 ± 0.004 Å |
| b | 19.641 ± 0.007 Å |
| c | 14.404 ± 0.005 Å |
| α | 90.12° |
| β | 90 ± 0.04° |
| γ | 90° |
| Cell volume | 3330 ± 2 Å3 |
| Cell temperature | 296 ± 2 K |
| Ambient diffraction temperature | 296 ± 2 K |
| Number of distinct elements | 5 |
| 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 | 0.1232 |
| Residual factor for significantly intense reflections | 0.0456 |
| Weighted residual factors for significantly intense reflections | 0.095 |
| Weighted residual factors for all reflections included in the refinement | 0.122 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.893 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
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