Information card for entry 7129215

Structure parameters

• Formula: C48 H38 Cd2 I4 N4 O11
• Calculated formula: C48 H32 Cd2 I4 N4 O11
• Title of publication: Cationic coordination polymers with thirteen-fold interpenetrating dia networks: selective coloration and ion-controlled photochromism
• Authors of publication: Li, Xin; Li, Yanger; Yang, Xiaoman; Yan, Chaoyue; Zhang, Kai; Liang, Xiaoxiao; Zhang, Jinli; Gai, Yanli; Xiong, Kecai
• Journal of publication: Chemical Communications
• Year of publication: 2021
• a: 10.9067 ± 0.0003 Å
• b: 33.3651 ± 0.001 Å
• c: 14.218 ± 0.0005 Å
• α: 90°
• β: 96.661 ± 0.001°
• γ: 90°
• Cell volume: 5139 ± 0.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• 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: 0.0813
• Residual factor for significantly intense reflections: 0.0742
• Weighted residual factors for significantly intense reflections: 0.2197
• Weighted residual factors for all reflections included in the refinement: 0.2269
• Goodness-of-fit parameter for all reflections included in the refinement: 1.059
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No