Information card for entry 7244906

Structure parameters

• Formula: C17 H20 N3 O3 V
• Calculated formula: C17 H20 N3 O3 V
• SMILES: c1cccc2C[N]3=Cc4ccc(cc4O[V]3([n]12)(=O)=O)N(CC)CC
• Title of publication: Synthesis, characterization and application of oxovanadium(iv) complexes with [NNO] donor ligands: X-ray structures of their corresponding dioxovanadium(v) complexes
• Authors of publication: Borah, Rakhimoni; Lahkar, Surabhi; Deori, Naranarayan; Brahma, Sanfaori
• Journal of publication: RSC Advances
• Year of publication: 2022
• Journal volume: 12
• Journal issue: 22
• Pages of publication: 13740 - 13748
• a: 6.6846 ± 0.0007 Å
• b: 8.3382 ± 0.0009 Å
• c: 30 ± 0.003 Å
• α: 90°
• β: 90.978 ± 0.003°
• γ: 90°
• Cell volume: 1671.9 ± 0.3 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 5
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.041
• Residual factor for significantly intense reflections: 0.0331
• Weighted residual factors for significantly intense reflections: 0.0845
• Weighted residual factors for all reflections included in the refinement: 0.0894
• Goodness-of-fit parameter for all reflections included in the refinement: 1.049
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No