Information card for entry 7232174

Structure parameters

• Formula: C13 H80.5 Cu0.25 Mo12 N6.5 Na4.75 O70 P8
• Calculated formula: C13 H40 Cu0.25 Mo12 N6.5 Na4.75 O70 P8
• Title of publication: Assembling [M(P4Mo6)2] (M = Na, Mn, Na/Cu) dimeric clusters via transition metal/sodium ions into 0D to 3D phosphomolybdates
• Authors of publication: Li, Wei; Zhu, Jian-Nan; Shen, Nan-Nan; Xiong, Wei-Wei; Huang, Xiao-Ying
• Journal of publication: CrystEngComm
• Year of publication: 2019
• Journal volume: 21
• Journal issue: 6
• Pages of publication: 971
• a: 13.262 ± 0.003 Å
• b: 13.36 ± 0.003 Å
• c: 22.492 ± 0.005 Å
• α: 99.302 ± 0.003°
• β: 90.283 ± 0.003°
• γ: 103.365 ± 0.003°
• Cell volume: 3822.5 ± 1.5 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 2 K
• Number of distinct elements: 8
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1819
• Residual factor for significantly intense reflections: 0.0743
• Weighted residual factors for significantly intense reflections: 0.1256
• Weighted residual factors for all reflections included in the refinement: 0.1577
• Goodness-of-fit parameter for all reflections included in the refinement: 1.034
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No