Information card for entry 7701591

Structure parameters

• Formula: C42 H26 Mn4 N2 O20
• Calculated formula: C42 H26 Mn4 N2 O20
• Title of publication: New multifunctional 3D porous metal-organic framework with selective gas adsorption, efficient chemical fixation of CO₂ and dye adsorption.
• Authors of publication: Cheng, Shan; Wu, Yunlong; Jin, Jing; Liu, Jiao; Wu, Dan; Yang, Guoping; Wang, Yao-Yu
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2019
• Journal volume: 48
• Journal issue: 22
• Pages of publication: 7612 - 7618
• a: 11.5081 ± 0.0018 Å
• b: 12.8515 ± 0.0019 Å
• c: 23.57 ± 0.003 Å
• α: 95.044 ± 0.003°
• β: 98.639 ± 0.003°
• γ: 104.313 ± 0.003°
• Cell volume: 3310.8 ± 0.8 ų
• Cell temperature: 296.15 K
• Ambient diffraction temperature: 296.15 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: 0.0967
• Residual factor for significantly intense reflections: 0.0685
• Weighted residual factors for significantly intense reflections: 0.1962
• Weighted residual factors for all reflections included in the refinement: 0.2272
• Goodness-of-fit parameter for all reflections included in the refinement: 0.999
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No