Information card for entry 7220105

Structure parameters

• Common name: Cd3(SO4)2(C6H5N2O2)2(H2O)4
• Chemical name: Cd3(SO4)2(C6H5N2O2)2(H2O)4
• Formula: C12 H26 Cd3 N4 O20 S2
• Calculated formula: C12 H26 Cd3 N4 O20 S2
• Title of publication: A 3-D Metal-Organic Framework with Rutile Topology Network, Right- or Left- Handed Helical Chains and Tunable UV-to-visible Photoluminescence
• Authors of publication: Zhou, Wei-Wei; Zhao, Wang; Wang, Feng-Wu; Fang, Wen-Yan; Liu, Dao-Fu; Wei, Yi-Jun; Xu, Mai; Zhao, Xing; Liang, Xian
• Journal of publication: RSC Adv.
• Year of publication: 2015
• a: 16.934 ± 0.007 Å
• b: 10.365 ± 0.004 Å
• c: 7.251 ± 0.003 Å
• α: 90°
• β: 92.875 ± 0.009°
• γ: 90°
• Cell volume: 1271.1 ± 0.9 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: 0.0383
• Residual factor for significantly intense reflections: 0.0376
• Weighted residual factors for significantly intense reflections: 0.0975
• Weighted residual factors for all reflections included in the refinement: 0.0984
• Goodness-of-fit parameter for all reflections included in the refinement: 1.026
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No