Information card for entry 7712032

Structure parameters

• Formula: C62 H42 N2 O13 Zn3
• Calculated formula: C62 H42 N2 O13 Zn3
• Title of publication: Two pillared-layer metal-organic frameworks based on the pinwheel trinuclear carboxylate-clusters of Zn(II) and Co(II): synthesis, crystal structures, magnetic study, and Lewis acid catalysis.
• Authors of publication: Das, Moyna; Jaswal, Vishakha; Bhambri, Himanshi; Das, Prasenjit; Maity, Suvendu; Ghosh, Prasanta; Mandal, Sanjay K.; Sarkar, Madhushree
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2023
• Journal volume: 52
• Journal issue: 5
• Pages of publication: 1449 - 1460
• a: 11.5156 ± 0.0012 Å
• b: 14.7449 ± 0.0015 Å
• c: 19.327 ± 0.002 Å
• α: 90°
• β: 102.805 ± 0.005°
• γ: 90°
• Cell volume: 3200 ± 0.6 ų
• Cell temperature: 297 ± 2 K
• Ambient diffraction temperature: 297 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.1505
• Residual factor for significantly intense reflections: 0.0991
• Weighted residual factors for significantly intense reflections: 0.2634
• Weighted residual factors for all reflections included in the refinement: 0.2952
• Goodness-of-fit parameter for all reflections included in the refinement: 1.066
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No