Information card for entry 7211962

Structure parameters

• Formula: C14 H8 Cd I3 N5 O4
• Calculated formula: C14 H6 Cd I3 N5 O4
• Title of publication: 1D zigzag chain vs. 1D helical chain: the role of the supramolecular interactions on the formation of chiral architecture
• Authors of publication: Dai, Fangna; He, Haiyan; Zhao, Xiaoliang; Ke, Yanxiong; Zhang, Guoqing; Sun, Daofeng
• Journal of publication: CrystEngComm
• Year of publication: 2010
• Journal volume: 12
• Journal issue: 2
• Pages of publication: 337
• a: 9.701 ± 0.002 Å
• b: 24.227 ± 0.005 Å
• c: 9.861 ± 0.002 Å
• α: 90°
• β: 111.821 ± 0.004°
• γ: 90°
• Cell volume: 2151.5 ± 0.8 ų
• Cell temperature: 273 ± 2 K
• Ambient diffraction temperature: 273 ± 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: 0.1435
• Residual factor for significantly intense reflections: 0.1076
• Weighted residual factors for significantly intense reflections: 0.2895
• Weighted residual factors for all reflections included in the refinement: 0.315
• Goodness-of-fit parameter for all reflections included in the refinement: 1.05
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No