Information card for entry 7713590

Structure parameters

• Formula: C40 H24 Cd N4 O8
• Calculated formula: C40 H24 Cd N4 O8
• Title of publication: The effect of conjugation degree of aromatic carboxylic acids on electronic and photo-responsive behaviors of naphthalenediimide-based coordination polymers
• Authors of publication: Kang, Ming; Gao, Bohong; Zhang, Shimin; Hao, Pengfei; Li, Gao-Peng; Shen, Junju; Fu, Yunlong
• Journal of publication: Dalton Transactions
• Year of publication: 2023
• a: 9.8114 ± 0.0004 Å
• b: 14.3212 ± 0.0007 Å
• c: 23.6696 ± 0.0011 Å
• α: 90°
• β: 99.8 ± 0.004°
• γ: 90°
• Cell volume: 3277.3 ± 0.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• 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: 0.1121
• Residual factor for significantly intense reflections: 0.0553
• Weighted residual factors for significantly intense reflections: 0.0837
• Weighted residual factors for all reflections included in the refinement: 0.1016
• Goodness-of-fit parameter for all reflections included in the refinement: 1.01
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No