Information card for entry 7118271

Structure parameters

• Formula: C52 H44 N2 O20 Zn3
• Calculated formula: C52 H44 N2 O20 Zn3
• Title of publication: Post-synthetic metalation in an anionic MOF for efficient catalytic activity and removal of heavy metal ions from aqueous solution.
• Authors of publication: Chakraborty, Anindita; Bhattacharyya, Sohini; Hazra, Arpan; Ghosh, Ashta Chandra; Maji, Tapas Kumar
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2016
• Journal volume: 52
• Journal issue: 13
• Pages of publication: 2831 - 2834
• a: 9.4533 ± 0.0019 Å
• b: 18.614 ± 0.004 Å
• c: 19.976 ± 0.004 Å
• α: 68.27 ± 0.03°
• β: 82.61 ± 0.03°
• γ: 82.18 ± 0.03°
• Cell volume: 3223.2 ± 1.3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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: 0.166
• Residual factor for significantly intense reflections: 0.1105
• Weighted residual factors for significantly intense reflections: 0.2956
• Weighted residual factors for all reflections included in the refinement: 0.3304
• Goodness-of-fit parameter for all reflections included in the refinement: 1.06
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No