Information card for entry 7047522

Structure parameters

• Formula: C33 H47 N5 O18 Zn
• Calculated formula: C33 H23 N5 O6 Zn
• Title of publication: Polymerization led selective detection and removal of Zn²⁺ and Cd²⁺ ions: isolation of Zn- and Cd-MOFs and reversibility studies.
• Authors of publication: Pandey, Saurabh; Kumar, Pramod; Gupta, Rajeev
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2018
• Journal volume: 47
• Journal issue: 41
• Pages of publication: 14686 - 14695
• a: 18.5144 ± 0.0018 Å
• b: 13.2579 ± 0.0013 Å
• c: 18.8316 ± 0.0018 Å
• α: 90°
• β: 105.277 ± 0.009°
• γ: 90°
• Cell volume: 4459.1 ± 0.8 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: I 1 2/c 1
• Hall space group symbol: -I 2yc
• Residual factor for all reflections: 0.1808
• Residual factor for significantly intense reflections: 0.1077
• Weighted residual factors for significantly intense reflections: 0.282
• Weighted residual factors for all reflections included in the refinement: 0.3225
• Goodness-of-fit parameter for all reflections included in the refinement: 1.041
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No