Information card for entry 2214311

Structure parameters

• Chemical name: <i>catena</i>-Poly[[[diididocadmium(II)]-μ-3,3',5,5'-tetramethyl-4,4'- bipyrazolyl-κ^2^<i>N</i>:<i>N</i>'] methanol solvate]
• Formula: C11 H18 Cd I2 N4 O
• Calculated formula: C11 H18 Cd I2 N4 O
• SMILES: [Cd](I)(I)([n]1[nH]c(c(c1C)c1c(n[nH]c1C)C)C)[n]1[nH]c(c(c2c([n]([Cd](I)I)[nH]c2C)C)c1C)C.OC.OC
• Title of publication: <i>catena</i>-Poly[[[diididocadmium(II)]-μ-3,3',5,5'-tetramethyl-4,4'-bipyrazolyl-κ^2^<i>N</i>:<i>N</i>'] methanol solvate]
• Authors of publication: Li, Dong-Qing; Hou, Lei; Ng, Seik Weng
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 7
• Pages of publication: m1864 - m1864
• a: 11.1294 ± 0.0006 Å
• b: 12.2109 ± 0.0007 Å
• c: 13.2924 ± 0.0007 Å
• α: 90°
• β: 101.008 ± 0.001°
• γ: 90°
• Cell volume: 1773.2 ± 0.17 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• 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: 0.034
• Residual factor for significantly intense reflections: 0.031
• Weighted residual factors for significantly intense reflections: 0.088
• Weighted residual factors for all reflections included in the refinement: 0.09
• Goodness-of-fit parameter for all reflections included in the refinement: 1.11
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes