Information card for entry 2204889

Structure parameters

• Common name: (2-amino-4,6-dimethylpyrimidine)(cadmium(II)thiocyante)
• Chemical name: catena-Poly[[[diaquacadmium(II)]-di-μ-thiocyanato] bis(2-amino-4,6-dimethylpyrimidine)]
• Formula: C14 H22 Cd N8 O2 S2
• Calculated formula: C14 H22 Cd N8 O2 S2
• Title of publication: <i>catena</i>-Poly[[[diaquacadmium(II)]-di-μ-thiocyanato] bis(2-amino-4,6-dimethylpyrimidine)]
• Authors of publication: Packianathan Thomas Muthiah; Madhukar Hemamalini; Ray J. Butcher
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2005
• Journal volume: 61
• Journal issue: 1
• Pages of publication: m63 - m65
• a: 5.7221 ± 0.0004 Å
• b: 10.3906 ± 0.0008 Å
• c: 10.4865 ± 0.0008 Å
• α: 117.442 ± 0.001°
• β: 101.677 ± 0.0008°
• γ: 92.951 ± 0.001°
• Cell volume: 534.31 ± 0.07 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0342
• Residual factor for significantly intense reflections: 0.0326
• Weighted residual factors for significantly intense reflections: 0.0853
• Weighted residual factors for all reflections included in the refinement: 0.0863
• Goodness-of-fit parameter for all reflections included in the refinement: 1.061
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes