Information card for entry 7031084

Structure parameters

• Formula: C22 H20 N O4 V
• Calculated formula: C22 H20 N O4 V
• SMILES: [V]12(Oc3c(C=[N]2c2c(O1)cccc2)cccc3c1ccccc1)(OC(C)C)=O
• Title of publication: Biphenyl derived Schiff-base vanadium(V) complexes with pendant OH-groups–structure, characterization and hydrogen peroxide mediated sulfide oxygenation.
• Authors of publication: Plitt, Patrick; Pritzkow, Hans; Kramer, Roland
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2004
• Journal issue: 15
• Pages of publication: 2314 - 2320
• a: 8.0992 ± 0.0004 Å
• b: 12.0724 ± 0.0005 Å
• c: 19.3885 ± 0.0009 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1895.75 ± 0.15 ų
• Cell temperature: 103 ± 2 K
• Ambient diffraction temperature: 103 ± 2 K
• Number of distinct elements: 5
• Space group number: 33
• Hermann-Mauguin space group symbol: P n a 21
• Hall space group symbol: P 2c -2n
• Residual factor for all reflections: 0.0425
• Residual factor for significantly intense reflections: 0.0342
• Weighted residual factors for significantly intense reflections: 0.0801
• Weighted residual factors for all reflections included in the refinement: 0.0857
• Goodness-of-fit parameter for all reflections included in the refinement: 1.056
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No