Information card for entry 4317537

Structure parameters

• Common name: PbPh2Cl2.VO(3-MeOsalen).VO(3-MeOsalen).H2O
• Chemical name: {Diphenyllead dichloride.[N,N'-bis(3-methoxysalicylidene)ethane-1,2-diaminato]oxovan adium(IV)}(1/1).[N,N'-bis(3-methoxysalicylidene)ethane-1,2-diaminato]m onoaqua oxovanadium(IV)(1/1)
• Formula: C50 H49 Cl2 N5 O11 Pb V2
• Calculated formula: C50 H49 Cl2 N5 O11 Pb V2
• SMILES: [Pb](Cl)(Cl)(O[V]123([N](CC[N]1=Cc1c(O3)c(OC)ccc1)=Cc1cccc(OC)c1O2)[OH2])(O[V]123[N](=Cc4c(O3)c(OC)ccc4)CC[N]1=Cc1cccc(OC)c1O2)(c1ccccc1)c1ccccc1.N#CC
• Title of publication: Donor Properties of the Vanadyl Ion: Reactions of Vanadyl Salicylaldimine β-Ketimine and Acetylacetonato Complexes with Groups 14 and 15 Lewis Acids
• Authors of publication: B. Cashin; D. Cunningham; P. Daly; P. McArdle; M. Munroe; N. Ní Chonchubhair
• Journal of publication: Inorganic Chemistry
• Year of publication: 2002
• Journal volume: 41
• Pages of publication: 773 - 782
• a: 12.0059 ± 0.0011 Å
• b: 12.872 ± 0.002 Å
• c: 19.36 ± 0.002 Å
• α: 71.559 ± 0.011°
• β: 82.276 ± 0.008°
• γ: 66.166 ± 0.01°
• Cell volume: 2596.1 ± 0.6 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0231
• Residual factor for significantly intense reflections: 0.0214
• Weighted residual factors for significantly intense reflections: 0.0503
• Weighted residual factors for all reflections included in the refinement: 0.0509
• Goodness-of-fit parameter for all reflections included in the refinement: 1.108
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No