Information card for entry 7032081

Structure parameters

• Formula: C24 H86 B6 Cu3 N18 O73 P12 V12
• Calculated formula: C24 H85.98 B6 Cu3 N18 O73 P12 V12
• Title of publication: Layered V-B-O polyoxometalate nets linked by diethylenetriamine complexes with dangling amine groups.
• Authors of publication: Chen, Hong; Zhang, Yunfeng; Yu, Zheng-Bao; Sun, Junliang
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2014
• Journal volume: 43
• Journal issue: 41
• Pages of publication: 15283 - 15286
• a: 18.0955 ± 0.0002 Å
• b: 18.0955 ± 0.0002 Å
• c: 30.0074 ± 0.0005 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 8509.42 ± 0.19 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 8
• Space group number: 148
• Hermann-Mauguin space group symbol: R -3 :H
• Hall space group symbol: -R 3
• Residual factor for all reflections: 0.0849
• Residual factor for significantly intense reflections: 0.0674
• Weighted residual factors for significantly intense reflections: 0.206
• Weighted residual factors for all reflections included in the refinement: 0.2177
• Goodness-of-fit parameter for all reflections included in the refinement: 1.11
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No