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Information card for entry 7220653
Preview
| Coordinates | 7220653.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Formula | C19 H15 N4 O3 V |
|---|---|
| Calculated formula | C19 H15 N4 O3 V |
| SMILES | [V]12(OC(=N[N]2=C(c2[n]1cccc2)c1ccccc1)c1c(N)cccc1)(=O)=O |
| Title of publication | Oxidovanadium(V) complexes of aroylhydrazones incorporating heterocycles: Synthesis, characterization and study of DNA binding, photo-induced DNA cleavage and cytotoxic activities |
| Authors of publication | Dash, Subhashree Priyadarsini; Panda, Alok K.; Pasayat, Sagarika; Dinda, Rupam; Biswas, Ashis; Tiekink, Edward R. T.; Mukhopadhyay, Subhadip; Bhutia, Sujit; Kaminsky, Werner; Sinn, Ekkehard |
| Journal of publication | RSC Adv. |
| Year of publication | 2015 |
| a | 7.2745 ± 0.0002 Å |
| b | 14.3309 ± 0.0003 Å |
| c | 16.7694 ± 0.0004 Å |
| α | 87.92 ± 0.1° |
| β | 80.07 ± 0.1° |
| γ | 83.41 ± 0.1° |
| Cell volume | 1710.4 ± 0.6 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 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 | 0.0401 |
| Residual factor for significantly intense reflections | 0.0328 |
| Weighted residual factors for significantly intense reflections | 0.0862 |
| Weighted residual factors for all reflections included in the refinement | 0.0908 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.024 |
| Diffraction radiation wavelength | 0.71069 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301865 (current) | 2025-08-22 | Add cross-references to PubChem compounds in COD range 7/22/ Each referenced PubChem compound corresponds to the full crystal structure. |
7220653.cif |
| 171425 | 2015-12-10 | cod/ (antanas@echidna.ibt.lt) Removing _chemical_name_systematic tags with empty values from multiple entries. |
7220653.cif |
| 137694 | 2015-06-03 | cif/ Adding structures of 7220652, 7220653, 7220654, 7220655 via cif-deposit CGI script. |
7220653.cif |
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Users of the data should acknowledge the original authors of the
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