Information card for entry 7049488

Structure parameters

• Formula: H26 N4 O60 V20 Zn5
• Calculated formula: H26 N4 O60 V20 Zn5
• Title of publication: Synthesis, characterization and structure of (NH₄)₄[Zn₅VVO₅₆H₂(H₂O)₄] with a novel V₅O₁₄ layer.
• Authors of publication: Yuan, Youyou; Wang, Xiaoge; Chen, Pohua; Sun, Junliang
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2019
• Journal volume: 48
• Journal issue: 15
• Pages of publication: 4906 - 4911
• a: 10.3342 ± 0.0006 Å
• b: 8.1209 ± 0.0005 Å
• c: 14.7616 ± 0.0009 Å
• α: 90°
• β: 102.064 ± 0.006°
• γ: 90°
• Cell volume: 1211.48 ± 0.13 ų
• Cell temperature: 179.99 ± 0.1 K
• Ambient diffraction temperature: 179.99 ± 0.1 K
• Number of distinct elements: 5
• 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: 0.0806
• Residual factor for significantly intense reflections: 0.0468
• Weighted residual factors for significantly intense reflections: 0.1109
• Weighted residual factors for all reflections included in the refinement: 0.1184
• Goodness-of-fit parameter for all reflections included in the refinement: 0.973
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No