Information card for entry 7220353

Structure parameters

• Formula: C8 H29 Cr Cu2 Mo6 N16 O28
• Calculated formula: C8 H22 Cr Cu2 Mo6 N16 O28
• Title of publication: Polyoxometalate-directed assembly of various multinuclear metal‒organic complexes with 4-amino-1,2,4-triazole and selective photocatalysis for organic dye degradation
• Authors of publication: Wang, Xiu-Li; Gong, Chun-Hua; Zhang, Ju-Wen; Liu, Guo-Cheng; Kan, Xiao-Min; Xu, Na
• Journal of publication: CrystEngComm
• Year of publication: 2015
• Journal volume: 17
• Journal issue: 22
• Pages of publication: 4179
• a: 13.4466 ± 0.0011 Å
• b: 13.4785 ± 0.0011 Å
• c: 13.8805 ± 0.0012 Å
• α: 64.45 ± 0.0001°
• β: 61.819 ± 0.0001°
• γ: 78.75 ± 0.002°
• Cell volume: 2000.5 ± 0.3 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 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: 0.0929
• Residual factor for significantly intense reflections: 0.0532
• Weighted residual factors for significantly intense reflections: 0.143
• Weighted residual factors for all reflections included in the refinement: 0.1641
• Goodness-of-fit parameter for all reflections included in the refinement: 1.023
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No