Information card for entry 4306966

Structure parameters

• Common name: [V3(m3-O)(m-OOCCH2CH3)6(H2O)3]Cl*2H2O (5)
• Formula: C18 H40 Cl O18 V3
• Calculated formula: C18 H25 Cl O16 V3
• Title of publication: Structural and Spectroscopic Evidence for the Formation of Trinuclear and Tetranuclear Vanadium(III)/Carboxylate Complexes of Acetate and Related Derivatives in Aqueous Solution
• Authors of publication: Riya Mukherjee; Brenda A. Dougan; Fiona H. Fry; Scott D. Bunge; Christopher J. Ziegler; Nicola E. Brasch
• Journal of publication: Inorganic Chemistry
• Year of publication: 2007
• Journal volume: 46
• Pages of publication: 1575 - 1585
• a: 11.0342 ± 0.0018 Å
• b: 11.3901 ± 0.0019 Å
• c: 14.607 ± 0.002 Å
• α: 67.527 ± 0.003°
• β: 70.775 ± 0.003°
• γ: 66.979 ± 0.003°
• Cell volume: 1526 ± 0.4 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0491
• Residual factor for significantly intense reflections: 0.0386
• Weighted residual factors for significantly intense reflections: 0.0981
• Weighted residual factors for all reflections included in the refinement: 0.1084
• Goodness-of-fit parameter for all reflections included in the refinement: 0.427
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No