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Information card for entry 1563873
Preview
| Coordinates | 1563873.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C22 H16 N2 S4 |
|---|---|
| Calculated formula | C22 H16 N2 S4 |
| Title of publication | DNA-BSA interaction, cytotoxicity and molecular docking of mononuclear zinc complexes with reductively cleaved N2S2 Schiff base ligands |
| Authors of publication | Asadizadeh, Saeedeh; Amirnasr, Mehdi; Fadaei Tirani, Farzaneh; Mansouri, Alireza; Schenk, Kurt |
| Journal of publication | Inorganica Chimica Acta |
| Year of publication | 2018 |
| Journal volume | 483 |
| Pages of publication | 310 - 320 |
| a | 10.1979 ± 0.0002 Å |
| b | 18.1973 ± 0.0003 Å |
| c | 11.2886 ± 0.0002 Å |
| α | 90° |
| β | 98.958 ± 0.002° |
| γ | 90° |
| Cell volume | 2069.32 ± 0.07 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 4 |
| 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 | 0.0384 |
| Residual factor for significantly intense reflections | 0.0375 |
| Weighted residual factors for significantly intense reflections | 0.1 |
| Weighted residual factors for all reflections included in the refinement | 0.1008 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.122 |
| Diffraction radiation wavelength | 0.6957 Å |
| Diffraction radiation type | synchrotron |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 266893 (current) | 2021-07-02 | cif/ Adding structures of 1563873 via cif-deposit CGI script. |
1563873.cif |
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Users of the data should acknowledge the original authors of the
structural data.