Information card for entry 7717168

Structure parameters

• Formula: C24 H14 N2 O5 Zn1.5
• Calculated formula: C24 H14 N2 O5 Zn1.5
• Title of publication: Design and synthesis of pillared metal-organic frameworks featuring olefinic fragments
• Authors of publication: Mander, Rachel Leigh; Schmidt, Ashley; Ruf, Michael; Korzynski, Maciej Damian
• Journal of publication: Dalton Transactions
• Year of publication: 2024
• a: 16.5257 ± 0.0009 Å
• b: 16.8102 ± 0.001 Å
• c: 22.3845 ± 0.0018 Å
• α: 102.024 ± 0.005°
• β: 91.839 ± 0.005°
• γ: 89.923 ± 0.004°
• Cell volume: 6078.8 ± 0.7 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 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: 0.1762
• Residual factor for significantly intense reflections: 0.1259
• Weighted residual factors for significantly intense reflections: 0.305
• Weighted residual factors for all reflections included in the refinement: 0.3275
• Goodness-of-fit parameter for all reflections included in the refinement: 1.594
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No