Information card for entry 7720969

Structure parameters

• Formula: C20 H18 N4 O2
• Calculated formula: C20 H18 N4 O2
• Title of publication: Noncovalent assembly strategy to significantly enhance the iodine adsorption capacity of a Schiff-base macrocycle
• Authors of publication: Huang, Chao; He, Shan-Xian; Li, Rong-Feng; Zhu, Bixue
• Journal of publication: Dalton Transactions
• Year of publication: 2026
• a: 5.392 ± 0.003 Å
• b: 35.07 ± 0.02 Å
• c: 8.645 ± 0.006 Å
• α: 90°
• β: 93.24 ± 0.02°
• γ: 90°
• Cell volume: 1632.1 ± 1.7 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.1444
• Residual factor for significantly intense reflections: 0.078
• Weighted residual factors for significantly intense reflections: 0.1869
• Weighted residual factors for all reflections included in the refinement: 0.224
• Goodness-of-fit parameter for all reflections included in the refinement: 1.032
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No