Information card for entry 7249314

Structure parameters

• Formula: C26 H16 I2 N4 O4 Zn
• Calculated formula: C26 H16 I2 N4 O4 Zn
• Title of publication: The effect of iodide on electronic and photo-responsive behaviors of 1D naphthalenediimide-based zinc coordination polymers
• Authors of publication: Zhang, Yifang; Kang, Ming; Zhang, Shimin; Gao, Bohong; Hao, Pengfei; Shen, Junju; Li, Gao-Peng; Fu, Yunlong
• Journal of publication: CrystEngComm
• Year of publication: 2024
• a: 10.1573 ± 0.0009 Å
• b: 12.2406 ± 0.0011 Å
• c: 12.6327 ± 0.0012 Å
• α: 115.38 ± 0.002°
• β: 93.68 ± 0.003°
• γ: 107.83 ± 0.002°
• Cell volume: 1315.6 ± 0.2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1023
• Residual factor for significantly intense reflections: 0.0465
• Weighted residual factors for significantly intense reflections: 0.0805
• Weighted residual factors for all reflections included in the refinement: 0.0957
• Goodness-of-fit parameter for all reflections included in the refinement: 1.005
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No