Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 7719198
Preview
| Coordinates | 7719198.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C58 H72 N8 Ni4 O19 |
|---|---|
| Calculated formula | C58 H58 N8 Ni4 O19 |
| Title of publication | Coordination Clusters with [Ni4O4] Core as Catalysts for α‑Alkylation of Ketones with Benzyl Alcohols |
| Authors of publication | Nayek, Hari Pada; Kajal, Kajal; Kumar, Manish |
| Journal of publication | Dalton Transactions |
| Year of publication | 2025 |
| a | 13.7466 ± 0.0007 Å |
| b | 15.1921 ± 0.0008 Å |
| c | 18.7516 ± 0.001 Å |
| α | 101.961 ± 0.004° |
| β | 110.604 ± 0.005° |
| γ | 104.385 ± 0.004° |
| Cell volume | 3357.9 ± 0.4 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.1101 |
| Residual factor for significantly intense reflections | 0.0763 |
| Weighted residual factors for significantly intense reflections | 0.2378 |
| Weighted residual factors for all reflections included in the refinement | 0.2678 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.04 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301435 (current) | 2025-08-02 | cif/ Adding structures of 7719198, 7719199, 7719200 via cif-deposit CGI script. |
7719198.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.