Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 7717516
Preview
| Coordinates | 7717516.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C9 H9 Cl2 N3 O S |
|---|---|
| Calculated formula | C9 H9 Cl2 N3 O S |
| Title of publication | Synthesis, cytotoxicities, structural properties and comparison of dihalogeno-substituted-thiosemicarbazone ligands and mixed-ligand Ni(II) complexes. |
| Authors of publication | Avcu Altiparmak, Elif; Özen Eroğlu, Güneş; Özdemir, Namık; Erdem Kuruca, Serap; Bal Demirci, Tülay |
| Journal of publication | Dalton transactions (Cambridge, England : 2003) |
| Year of publication | 2025 |
| Journal volume | 54 |
| Journal issue | 4 |
| Pages of publication | 1454 - 1467 |
| a | 6.2672 ± 0.0005 Å |
| b | 7.9274 ± 0.0006 Å |
| c | 12.4219 ± 0.0009 Å |
| α | 82.624 ± 0.006° |
| β | 78.692 ± 0.006° |
| γ | 76.836 ± 0.006° |
| Cell volume | 587 ± 0.08 Å3 |
| Cell temperature | 296 ± 2 K |
| Ambient diffraction temperature | 296 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0599 |
| Residual factor for significantly intense reflections | 0.0514 |
| Weighted residual factors for significantly intense reflections | 0.1499 |
| Weighted residual factors for all reflections included in the refinement | 0.1566 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.067 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 298288 (current) | 2025-03-04 | cif/ Updating files of 7717516, 7717517, 7717518 Original log message: Adding full bibliography for 7717516--7717518.cif. |
7717516.cif |
| 295987 | 2024-11-19 | cif/ Adding structures of 7717516, 7717517, 7717518 via cif-deposit CGI script. |
7717516.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.