Information card for entry 7030077

Structure parameters

• Formula: B6 Na14 Ni8 O122 Si2 W18
• Calculated formula: B6 Na13.5967 Ni8 O107.08 Si2 W18
• Title of publication: Borate-templated self-assembly of multinuclear nickel(II)-containing POMs.
• Authors of publication: Li, Shujun; Liu, Shuxia; Tang, Qun; Liu, Yiwei; He, Danfeng; Wang, Shengtian; Shi, Zhan
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2013
• Journal volume: 42
• Journal issue: 37
• Pages of publication: 13319 - 13322
• a: 21.8496 ± 0.0016 Å
• b: 21.8496 ± 0.0016 Å
• c: 44.606 ± 0.004 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 18442 ± 3 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 6
• Space group number: 176
• Hermann-Mauguin space group symbol: P 63/m
• Hall space group symbol: -P 6c
• Residual factor for all reflections: 0.0885
• Residual factor for significantly intense reflections: 0.0633
• Weighted residual factors for significantly intense reflections: 0.1377
• Weighted residual factors for all reflections included in the refinement: 0.1478
• Goodness-of-fit parameter for all reflections included in the refinement: 1.099
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No