Information card for entry 7239865

Structure parameters

• Formula: C32 H34 Cl4 Cu24 Mo12 N48 O41 P
• Calculated formula: C32 H34 Cl4 Cu24 Mo12 N48 O41 P
• Title of publication: Graphite-like polyoxometalate-based metal‒organic framework as an efficient anode for lithium ion batteries
• Authors of publication: Yang, Xiya; Zhu, Peipei; Ma, Xiaoliang; Li, Wenjing; Tan, Zenglong; Sha, Jingquan
• Journal of publication: CrystEngComm
• Year of publication: 2020
• a: 10.0426 ± 0.0014 Å
• b: 15.734 ± 0.002 Å
• c: 17.504 ± 0.003 Å
• α: 101.186 ± 0.002°
• β: 96.301 ± 0.002°
• γ: 101.842 ± 0.002°
• Cell volume: 2623.1 ± 0.7 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 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: 0.0757
• Residual factor for significantly intense reflections: 0.0472
• Weighted residual factors for significantly intense reflections: 0.1338
• Weighted residual factors for all reflections included in the refinement: 0.1527
• Goodness-of-fit parameter for all reflections included in the refinement: 1.038
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No