Information card for entry 7226038

Structure parameters

• Formula: C66 H62 Mn3 N4 O24
• Calculated formula: C66 H62 Mn3 N4 O24
• Title of publication: Four metal‒organic frameworks based on a semirigid tripodal ligand and different secondary building units: structures and electrochemical performance
• Authors of publication: Lin, Xiao-Ming; Niu, Ji-Liang; Chen, Dan-Ni; Lu, Yan-Na; Zhang, Gang; Cai, Yue-Peng
• Journal of publication: CrystEngComm
• Year of publication: 2016
• Journal volume: 18
• Journal issue: 36
• Pages of publication: 6841
• a: 10.2193 ± 0.0006 Å
• b: 11.1861 ± 0.0005 Å
• c: 16.235 ± 0.0007 Å
• α: 95.006 ± 0.001°
• β: 91.712 ± 0.002°
• γ: 112.69 ± 0.001°
• Cell volume: 1701.64 ± 0.15 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1147
• Residual factor for significantly intense reflections: 0.05
• Weighted residual factors for significantly intense reflections: 0.1157
• Weighted residual factors for all reflections included in the refinement: 0.16
• Goodness-of-fit parameter for all reflections included in the refinement: 1.031
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No