Information card for entry 7222140

Structure parameters

• Formula: C48 H60 B Co2.5 N24 O46 W12
• Calculated formula: C48 H54 B Co2.5 N24 O45 W12
• Title of publication: Polyoxometalate-based metal‒organic coordination networks for heterogeneous catalytic desulfurization
• Authors of publication: Ma, Yuan-Yuan; Tan, Hua-Qiao; Wang, Yong-Hui; Hao, Xiu-Li; Feng, Xiao-Jia; Zang, Hong-Ying; Li, Yang-Guang
• Journal of publication: CrystEngComm
• Year of publication: 2015
• Journal volume: 17
• Journal issue: 41
• Pages of publication: 7938
• a: 11.7046 ± 0.0009 Å
• b: 14.5353 ± 0.0011 Å
• c: 28.585 ± 0.002 Å
• α: 85.514 ± 0.001°
• β: 78.994 ± 0.001°
• γ: 66.817 ± 0.001°
• Cell volume: 4388.2 ± 0.6 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0555
• Residual factor for significantly intense reflections: 0.042
• Weighted residual factors for significantly intense reflections: 0.0962
• Weighted residual factors for all reflections included in the refinement: 0.1011
• Goodness-of-fit parameter for all reflections included in the refinement: 1.026
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No