Information card for entry 2220790

Structure parameters

• Chemical name: <i>catena</i>-Poly[[bis(3-methyl-4-nitropyridine <i>N</i>-oxide-κ<i>O</i>)cadmium(II)]-di-μ-dicyanamido- κ^4^<i>N</i>^1^:<i>N</i>^5^]
• Formula: C16 H12 Cd N10 O6
• Calculated formula: C16 H12 Cd N10 O6
• SMILES: [Cd]1([O]=n2ccc(N(=O)=O)c(c2)C)([O]=n2ccc(N(=O)=O)c(C)c2)([N]#CN=C=N[Cd]([O]=n2ccc(N(=O)=O)c(C)c2)([O]=n2ccc(N(=O)=O)c(C)c2)[N]#CN=C=N1)(N=C=NC#N)N=C=NC#N
• Title of publication: <i>catena</i>-Poly[[bis(3-methyl-4-nitropyridine <i>N</i>-oxide-κ<i>O</i>)cadmium(II)]-di-μ-dicyanamido-κ^4^<i>N</i>^1^:<i>N</i>^5^]
• Authors of publication: Wei, Rong-Min
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2009
• Journal volume: 65
• Journal issue: 2
• Pages of publication: m154
• a: 7.5472 ± 0.0008 Å
• b: 7.5606 ± 0.0008 Å
• c: 9.8352 ± 0.001 Å
• α: 83.68 ± 0.001°
• β: 68.528 ± 0.001°
• γ: 79.639 ± 0.001°
• Cell volume: 513.14 ± 0.09 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0206
• Residual factor for significantly intense reflections: 0.0204
• Weighted residual factors for significantly intense reflections: 0.0529
• Weighted residual factors for all reflections included in the refinement: 0.053
• Goodness-of-fit parameter for all reflections included in the refinement: 0.995
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes