Information card for entry 2009299

Structure parameters

• Chemical name: Poly[bis(imidazole)bis(thiocyanato)cadmium(II)]
• Formula: C8 H8 Cd N6 S2
• Calculated formula: C8 H8 Cd N6 S2
• SMILES: S=C=N[Cd]([n]1c[nH]cc1)([n]1c[nH]cc1)N=C=S
• Title of publication: <i>catena</i>-Poly[[bis(imidazole-<i>N</i>^3^)cadmium(II)]-bis(μ-thiocyanato)-<i>S</i>:<i>N</i>;<i>N</i>:<i>S</i>]
• Authors of publication: Chen, Hong-Ji; Yang, Guang; Chen, Xiao-Ming
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1999
• Journal volume: 55
• Journal issue: 12
• Pages of publication: 2012 - 2014
• a: 7.804 ± 0.004 Å
• b: 5.765 ± 0.002 Å
• c: 14.164 ± 0.009 Å
• α: 90°
• β: 102.37 ± 0.01°
• γ: 90°
• Cell volume: 622.4 ± 0.6 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.027
• Residual factor for significantly intense reflections: 0.023
• Weighted residual factors for all reflections included in the refinement: 0.059
• Goodness-of-fit parameter for all reflections included in the refinement: 1.114
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes