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Information card for entry 1565158
Preview
| Coordinates | 1565158.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C19 H15 Cl3 Cu N6 O3 S2 |
|---|---|
| Calculated formula | C19 H15 Cl3 Cu N6 O3 S2 |
| Title of publication | Synthesis, Characterisation and Crystal structure of a New Cu(II)-carboxamide Complex and CuO nanoparticles as New Catalysts in the CuAAC reaction and Investigation of their Antibacterial activity |
| Authors of publication | Kiani, Mahsa; Bagherzadeh, Mojtaba; Meghdadi, Soraia; Fadaei-Tirani, Farzaneh; Babaie, Maryam; Schenk-Joß, Kurt |
| Journal of publication | Inorganica Chimica Acta |
| Year of publication | 2020 |
| Journal volume | 506 |
| Pages of publication | 119514 |
| a | 9.8921 ± 0.0006 Å |
| b | 14.3386 ± 0.0006 Å |
| c | 16.9234 ± 0.0011 Å |
| α | 90° |
| β | 92.123 ± 0.005° |
| γ | 90° |
| Cell volume | 2398.7 ± 0.2 Å3 |
| Cell temperature | 292 ± 2 K |
| Ambient diffraction temperature | 292 K |
| Number of distinct elements | 7 |
| 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 | 0.0968 |
| Residual factor for significantly intense reflections | 0.0418 |
| Weighted residual factors for significantly intense reflections | 0.0842 |
| Weighted residual factors for all reflections included in the refinement | 0.1026 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.898 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 270561 (current) | 2021-11-10 | cif/ Adding structures of 1565158 via cif-deposit CGI script. |
1565158.cif |
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