Information card for entry 7122381

Structure parameters

• Chemical name: Co-pydc-TPB-activated
• Formula: C50.01 H28 Co3 N4 O13
• Calculated formula: C50.01 H28 Co3 N3.9999 O13
• Title of publication: Remoulding a MOF's pores by auxiliary ligand introduction for stability improvement and highly selective CO₂-capture.
• Authors of publication: Zhang, Qing-Qing; Liu, Xiao-Fei; Ma, Lin; Wei, Yong-Sheng; Wang, Zhao-Yang; Xu, Hong; Zang, Shuang-Quan
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2018
• Journal volume: 54
• Journal issue: 85
• Pages of publication: 12029 - 12032
• a: 14.3406 ± 0.0002 Å
• b: 14.3406 ± 0.0002 Å
• c: 14.1626 ± 0.0004 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 2522.37 ± 0.09 ų
• Cell temperature: 150 ± 0.1 K
• Ambient diffraction temperature: 150 ± 0.1 K
• Number of distinct elements: 5
• Space group number: 190
• Hermann-Mauguin space group symbol: P -6 2 c
• Hall space group symbol: P -6c -2c
• Residual factor for all reflections: 0.0633
• Residual factor for significantly intense reflections: 0.0595
• Weighted residual factors for significantly intense reflections: 0.1627
• Weighted residual factors for all reflections included in the refinement: 0.1659
• Goodness-of-fit parameter for all reflections included in the refinement: 1.09
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No