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Information card for entry 7059715
Preview
| Coordinates | 7059715.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Common name | SA_30 |
|---|---|
| Chemical name | SA_30 |
| Formula | C27 H38 Cl2 Cu N2 O3 |
| Calculated formula | C27 H38 Cl2 Cu N2 O3 |
| SMILES | c12c(cc(c(c1C[N]1(COC)CC(C)[NH]3Cc4c(c(cc(c4C)Cl)C(C)C)O[Cu]13O2)C)Cl)C(C)C |
| Title of publication | Unusual chemistry of Cu(ii) salan complexes: synthesis, characterization and superoxide dismutase activity |
| Authors of publication | Roy, Satabdi; Banerjee, Atanu; Lima, Sudhir; Horn Jr, Adolfo; Sampaio, Raquel M. S. N.; Ribeiro, Nádia; Correia, Isabel; Avecilla, Fernando; Carvalho, M. Fernanda N. N.; Kuznetsov, Maxim L.; Pessoa, João Costa; Kaminsky, Werner; Dinda, Rupam |
| Journal of publication | New Journal of Chemistry |
| Year of publication | 2020 |
| Journal volume | 44 |
| Journal issue | 27 |
| Pages of publication | 11457 - 11470 |
| a | 15.048 ± 0.002 Å |
| b | 21.675 ± 0.003 Å |
| c | 16.615 ± 0.002 Å |
| α | 90° |
| β | 93.091 ± 0.008° |
| γ | 90° |
| Cell volume | 5411.4 ± 1.2 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/a 1 |
| Hall space group symbol | -P 2yab |
| Residual factor for all reflections | 0.1662 |
| Residual factor for significantly intense reflections | 0.0875 |
| Weighted residual factors for significantly intense reflections | 0.2096 |
| Weighted residual factors for all reflections included in the refinement | 0.2579 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.026 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 295677 (current) | 2024-10-30 | Fixing Z values and formulae |
7059715.cif |
| 257679 | 2020-10-06 | cif/ Updating files of 7059712, 7059713, 7059714, 7059715 Original log message: Adding full bibliography for 7059712--7059715.cif. |
7059715.cif |
| 255058 | 2020-08-06 | cif/ Updating files of 7059712, 7059713, 7059714, 7059715 Original log message: Adding full bibliography for 7059712--7059715.cif. |
7059715.cif |
| 253265 | 2020-06-19 | cif/ Adding structures of 7059712, 7059713, 7059714, 7059715 via cif-deposit CGI script. |
7059715.cif |
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