Information card for entry 7244170

Structure parameters

• Formula: C64 H60 K2 Mo12 N8 Na2 O69 P8 Zn
• Calculated formula: C64 H54 Mo12 N8 Na2 O70 P8 Zn2
• Title of publication: Efficient visible-light-driven reduction of hexavalent chromium catalyzed by conjugated organic species modified hourglass-type phosphomolybdate hybrids
• Authors of publication: Bi, Hao-Xue; Yin, Xiao-Yu; Zhang, Xiu-Juan; Ma, Yuan-Yuan; Han, Zhan-Gang
• Journal of publication: CrystEngComm
• Year of publication: 2022
• Journal volume: 24
• Journal issue: 5
• Pages of publication: 1002 - 1009
• a: 12.079 ± 0.002 Å
• b: 13.62 ± 0.002 Å
• c: 17.023 ± 0.003 Å
• α: 75.738 ± 0.003°
• β: 80.286 ± 0.003°
• γ: 89.388 ± 0.003°
• Cell volume: 2673.9 ± 0.8 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296.15 K
• Number of distinct elements: 9
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0944
• Residual factor for significantly intense reflections: 0.0601
• Weighted residual factors for significantly intense reflections: 0.1444
• Weighted residual factors for all reflections included in the refinement: 0.1727
• Goodness-of-fit parameter for all reflections included in the refinement: 1.038
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No