Information card for entry 2234843

Structure parameters

• Chemical name: Poly[[bis[3-(1<i>H</i>-tetrazol-1-yl)propanoic acid-κ<i>N</i>^4^]cadmium]- di-μ-thiocyanato-κ^2^<i>N</i>:<i>S</i>;κ^2^<i>S</i>:<i>N</i>]
• Formula: C10 H12 Cd N10 O4 S2
• Calculated formula: C10 H12 Cd N10 O4 S2
• Title of publication: Poly[[bis[3-(1<i>H</i>-tetrazol-1-yl)propanoic acid-κ<i>N</i>^4^]cadmium]-di-μ-thiocyanato-κ^2^<i>N</i>:<i>S</i>;κ^2^<i>S</i>:<i>N</i>]
• Authors of publication: Wang, Jian-Guo; Zhang, Yuan; Su, Zhong-Xing; Liu, Xiang
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2012
• Journal volume: 68
• Journal issue: 5
• Pages of publication: m593 - m594
• a: 12.7402 ± 0.0019 Å
• b: 6.9555 ± 0.0011 Å
• c: 10.7549 ± 0.0016 Å
• α: 90°
• β: 106.809 ± 0.001°
• γ: 90°
• Cell volume: 912.3 ± 0.2 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 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: 0.0253
• Residual factor for significantly intense reflections: 0.0209
• Weighted residual factors for significantly intense reflections: 0.0497
• Weighted residual factors for all reflections included in the refinement: 0.0519
• Goodness-of-fit parameter for all reflections included in the refinement: 1.069
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes