Information card for entry 7700698

Structure parameters

• Formula: C48 H48 Cu2 Mo12 N24 O39 P
• Calculated formula: C48 H48 Cu2 Mo12 N24 O39 P
• Title of publication: Mo-Based crystal POMOFs with a high electrochemical capacitor performance.
• Authors of publication: Chai, Dongfeng; Xin, Jianjiao; Li, Bonan; Pang, Haijun; Ma, Huiyuan; Li, Kunqi; Xiao, Boxin; Wang, Xinming; Tan, Lichao
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2019
• Journal volume: 48
• Journal issue: 34
• Pages of publication: 13026 - 13033
• a: 10.953 ± 0.006 Å
• b: 15.982 ± 0.008 Å
• c: 24.08 ± 0.01 Å
• α: 90°
• β: 107.46 ± 0.02°
• γ: 90°
• Cell volume: 4021 ± 3 ų
• Cell temperature: 298 K
• Ambient diffraction temperature: 298 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.1111
• Residual factor for significantly intense reflections: 0.0608
• Weighted residual factors for significantly intense reflections: 0.1333
• Weighted residual factors for all reflections included in the refinement: 0.1535
• Goodness-of-fit parameter for all reflections included in the refinement: 1.032
• Diffraction radiation wavelength: 0.71 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No