Information card for entry 2210390

Structure parameters

• Chemical name: Poly[[bis(μ~2~-3,5-diamino-1,2,4-triazole)- κ^2^<i>N</i>^2^:<i>N</i>^4^;κ^2^<i>N</i>^4^:<i>N</i>^2^- μ~2~-sulfato-κ^2^<i>O</i>:<i>O</i>'-cadmium(II)] monohydrate]
• Formula: C4 H12 Cd N10 O5 S
• Calculated formula: C4 H12 Cd N10 O5 S
• Title of publication: Poly[[bis(μ~2~-3,5-diamino-1,2,4-triazole)-κ^2^<i>N</i>^2^:<i>N</i>^4^;κ^2^<i>N</i>^4^:<i>N</i>^2^-μ~2~-sulfato-κ^2^<i>O</i>:<i>O</i>'-cadmium(II)] monohydrate]
• Authors of publication: Zhang, Guo-Fang; Zhao, Shu-Min; She, Jiang-Bo; Ng, Seik Weng
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2006
• Journal volume: 62
• Journal issue: 9
• Pages of publication: m2148 - m2150
• a: 13.446 ± 0.001 Å
• b: 13.446 Å
• c: 27.98 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 5058.6 ± 0.5 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 2 K
• Number of distinct elements: 6
• Space group number: 110
• Hermann-Mauguin space group symbol: I 41 c d
• Hall space group symbol: I 4bw -2c
• Residual factor for all reflections: 0.034
• Residual factor for significantly intense reflections: 0.032
• Weighted residual factors for significantly intense reflections: 0.082
• Weighted residual factors for all reflections included in the refinement: 0.085
• Goodness-of-fit parameter for all reflections included in the refinement: 1.08
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes