Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 1563872
Preview
| Coordinates | 1563872.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C30 H28 N2 O4 S2 Zn |
|---|---|
| Calculated formula | C30 H28 N2 O4 S2 Zn |
| 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 | 11.2204 ± 0.0001 Å |
| b | 21.2286 ± 0.0002 Å |
| c | 11.9095 ± 0.0002 Å |
| α | 90° |
| β | 103.462 ± 0.001° |
| γ | 90° |
| Cell volume | 2758.82 ± 0.06 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/n 1 |
| Hall space group symbol | -P 2yn |
| Residual factor for all reflections | 0.0313 |
| Residual factor for significantly intense reflections | 0.0299 |
| Weighted residual factors for significantly intense reflections | 0.0889 |
| Weighted residual factors for all reflections included in the refinement | 0.0901 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.093 |
| Diffraction radiation wavelength | 0.69701 Å |
| Diffraction radiation type | synchrotron |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 266892 (current) | 2021-07-02 | cif/ Adding structures of 1563872 via cif-deposit CGI script. |
1563872.cif |
All data in the COD and the database itself are dedicated to the
public domain and licensed under the
CC0
License
.
Users of the data should acknowledge the original authors of the
structural data.