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Information card for entry 1556617
Preview
| Coordinates | 1556617.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C17 H26 Cu I N6 |
|---|---|
| Calculated formula | C17 H26 Cu I N6 |
| SMILES | I[Cu]1[N](=C2N(CCN2C)C)c2ccccc2C[N]1=C1N(CCN1C)C |
| Title of publication | Fluorescent Bis(guanidine) Copper Complexes as Precursors for Hydroxylation Catalysis |
| Authors of publication | Strassl, F.; Hoffmann, A.; Grimm-Lebsanft, B.; Rukser, D.; Biebl, F.; Tran, M.A.; Metz, F.; Rubhausen, M.; Herres-Pawlis, S. |
| Journal of publication | Inorganics |
| Year of publication | 2018 |
| Journal volume | 6 |
| Pages of publication | 114 |
| a | 18.055 ± 0.003 Å |
| b | 26.458 ± 0.005 Å |
| c | 16.438 ± 0.003 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 7852 ± 2 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 43 |
| Hermann-Mauguin space group symbol | F d d 2 |
| Hall space group symbol | F 2 -2d |
| Residual factor for all reflections | 0.0581 |
| Residual factor for significantly intense reflections | 0.0434 |
| Weighted residual factors for significantly intense reflections | 0.0951 |
| Weighted residual factors for all reflections included in the refinement | 0.1043 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.095 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 245254 (current) | 2019-12-17 | cif/ Adding structures of 1556617 via cif-deposit CGI script. |
1556617.cif |
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Users of the data should acknowledge the original authors of the
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