Information card for entry 7714514

Structure parameters

• Formula: C22 H53 N25 O26.5 V3
• Calculated formula: C22 H35 N25 O17.5 V3
• Title of publication: Asymmetric dinuclear, hexanuclear and octanuclear oxovanadium citrates with triazolates: novel mixed-ligands and mixed-valence complexes.
• Authors of publication: Xie, Zhen-Lang; Zhou, Zhao-Hui
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2023
• Journal volume: 53
• Journal issue: 1
• Pages of publication: 186 - 195
• a: 10.4466 ± 0.0004 Å
• b: 10.7317 ± 0.0004 Å
• c: 22.6402 ± 0.0006 Å
• α: 82.025 ± 0.002°
• β: 89.802 ± 0.003°
• γ: 78.306 ± 0.003°
• Cell volume: 2460.67 ± 0.15 ų
• Cell temperature: 233 ± 0.1 K
• Ambient diffraction temperature: 233 ± 0.1 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: 0.0742
• Residual factor for significantly intense reflections: 0.0608
• Weighted residual factors for significantly intense reflections: 0.1435
• Weighted residual factors for all reflections included in the refinement: 0.1502
• Goodness-of-fit parameter for all reflections included in the refinement: 1.083
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No