Information card for entry 7220653

Structure parameters

• 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 ų
• 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