Information card for entry 7715867

Structure parameters

• Common name: [H2L2]Cl
• Chemical name: {4-hydroxy-3-[(2-nicotinoylhydrazono)methyl]benzyl} triphenylphosphonium chloride
• Formula: C32 H27 Cl N3 O2 P
• Calculated formula: C32 H27 Cl N3 O2 P
• SMILES: [Cl-].[P+](c1ccccc1)(c1ccccc1)(c1ccccc1)Cc1cc(c(O)cc1)/C=N/NC(=O)c1cnccc1
• 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: 11.6944 ± 0.0005 Å
• b: 10.2221 ± 0.0004 Å
• c: 23.3093 ± 0.0008 Å
• α: 90°
• β: 102.202 ± 0.001°
• γ: 90°
• Cell volume: 2723.48 ± 0.18 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.1123
• Residual factor for significantly intense reflections: 0.0571
• Weighted residual factors for significantly intense reflections: 0.0934
• Weighted residual factors for all reflections included in the refinement: 0.1078
• 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