Information card for entry 7715864

Structure parameters

• Common name: [VO2(L2)]CH3OH 4H2O
• Chemical name: {4-hydroxy-3-[(2-nicotinoylhydrazono)methyl] benzyl}triphenylphosphonium chloride vanadium (V) dioxo complex
• Formula: C33 H37 N3 O9 P V
• Calculated formula: C33 H33 N3 O9 P V
• SMILES: [V]12(Oc3c(cc(C[P+](c4ccccc4)(c4ccccc4)c4ccccc4)cc3)C=[N]2N=C(O1)c1cccnc1)(=O)=O.OC.O.O.O.O
• Title of publication: Vanadium(V) complexes derived from triphenylphosphonium and hydrazides: cytotoxicity evaluation and interaction with biomolecules.
• Authors of publication: Martins, Francisco Mainardi; Iglesias, Bernardo Almeida; Chaves, Otávio Augusto; Gutknecht da Silva, Jean Lucas; Leal, Daniela Bitencourt Rosa; Back, Davi Fernando
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2024
• Journal volume: 53
• Journal issue: 19
• Pages of publication: 8315 - 8327
• a: 11.2125 ± 0.0003 Å
• b: 12.2196 ± 0.0004 Å
• c: 14.1895 ± 0.0004 Å
• α: 67.99 ± 0.001°
• β: 78.423 ± 0.001°
• γ: 65.298 ± 0.001°
• Cell volume: 1635.27 ± 0.08 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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: 0.0478
• Residual factor for significantly intense reflections: 0.039
• Weighted residual factors for significantly intense reflections: 0.0938
• Weighted residual factors for all reflections included in the refinement: 0.0984
• Goodness-of-fit parameter for all reflections included in the refinement: 1.027
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No