Information card for entry 7000196

Structure parameters

• Formula: C16 H36.67 Cu N4 O6.33 V2
• Calculated formula: C16 H36 Cu N4 O6.33333 V2
• Title of publication: Vanadium polyoxoanion-bridged macrocyclic metal complexes: from one-dimensional to three-dimensional structures
• Authors of publication: Ou, Guang-Chuan; Jiang, Long; Feng, Xiao-Long; Lu, Tong-Bu
• Journal of publication: Dalton Transactions
• Year of publication: 2009
• Journal issue: 1
• Pages of publication: 71 - 76
• a: 26.829 ± 0.003 Å
• b: 26.829 ± 0.003 Å
• c: 8.864 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 5525.5 ± 1.5 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 6
• Space group number: 148
• Hermann-Mauguin space group symbol: R -3 :H
• Hall space group symbol: -R 3
• Residual factor for all reflections: 0.0567
• Residual factor for significantly intense reflections: 0.0402
• Weighted residual factors for significantly intense reflections: 0.1247
• Weighted residual factors for all reflections included in the refinement: 0.134
• Goodness-of-fit parameter for all reflections included in the refinement: 1.127
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No