Information card for entry 7217156

Structure parameters

• Formula: C70 H62 Cd3 N28 O8 S5 W2
• Calculated formula: C70 H62 Cd3 N28 O8 S5 W2
• Title of publication: Sandwich-like octacyanometalate-based cadmium assemblies with the 4,4′-dipyridyl sulfide ligand
• Authors of publication: Yang, Dan; Zhou, Hu; Yuan, Ai-Hua; Li, Yi-Zhi
• Journal of publication: CrystEngComm
• Year of publication: 2014
• Journal volume: 16
• Journal issue: 36
• Pages of publication: 8344
• a: 38.4736 ± 0.0012 Å
• b: 12.0047 ± 0.001 Å
• c: 19.0031 ± 0.0016 Å
• α: 90°
• β: 104.334 ± 0.003°
• γ: 90°
• Cell volume: 8503.6 ± 1 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 7
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0464
• Residual factor for significantly intense reflections: 0.0461
• Weighted residual factors for significantly intense reflections: 0.1163
• Weighted residual factors for all reflections included in the refinement: 0.1164
• Goodness-of-fit parameter for all reflections included in the refinement: 1.073
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No