Information card for entry 4339649

Structure parameters

• Formula: C24 H36 B4 F16 N12 O V2
• Calculated formula: C24 H36 B4 F16 N12 O V2
• Title of publication: Synthesis, structure, and magnetic properties of [(CH3CN)5V-O-V(CH3CN)5][BF4]4.
• Authors of publication: Cissell, Julie A.; Kaur, Narpinder; Nellutla, Saritha; Dalal, Naresh S.; Vaid, Thomas P.
• Journal of publication: Inorganic chemistry
• Year of publication: 2007
• Journal volume: 46
• Journal issue: 23
• Pages of publication: 9672 - 9677
• a: 10.061 ± 0.0005 Å
• b: 22.2252 ± 0.001 Å
• c: 10.7939 ± 0.0005 Å
• α: 90°
• β: 109.6 ± 0.001°
• γ: 90°
• Cell volume: 2273.75 ± 0.19 ų
• Cell temperature: 223 ± 2 K
• Ambient diffraction temperature: 223 ± 2 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0584
• Residual factor for significantly intense reflections: 0.0496
• Weighted residual factors for significantly intense reflections: 0.1324
• Weighted residual factors for all reflections included in the refinement: 0.1431
• Goodness-of-fit parameter for all reflections included in the refinement: 1.065
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No