Information card for entry 7239982

Structure parameters

• Formula: C32 H24 Cd N2 O12 S2
• Calculated formula: C32 H24 Cd N2 O12 S2
• Title of publication: Multiple hydrogen bonded three-dimensional supramolecular architecture composed of unique three-fold interlocked anionic Zn(II)-coordination architecture
• Authors of publication: Ke, Hua; Chen, Qi-Hua; Liao, Jian-Zhen; Lu, Can-Zhong
• Journal of publication: CrystEngComm
• Year of publication: 2020
• a: 13.5349 ± 0.0008 Å
• b: 8.6599 ± 0.0006 Å
• c: 26.4575 ± 0.0017 Å
• α: 90°
• β: 95.607 ± 0.006°
• γ: 90°
• Cell volume: 3086.3 ± 0.3 ų
• Cell temperature: 100.01 ± 0.13 K
• Ambient diffraction temperature: 100.01 ± 0.13 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: I 1 2/c 1
• Hall space group symbol: -I 2yc
• Residual factor for all reflections: 0.0342
• Residual factor for significantly intense reflections: 0.0327
• Weighted residual factors for significantly intense reflections: 0.0876
• Weighted residual factors for all reflections included in the refinement: 0.0888
• Goodness-of-fit parameter for all reflections included in the refinement: 1.075
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No