Information card for entry 2208129

Structure parameters

• Chemical name: catena-Poly[cadmium(II)-di-μ-chloro-μ-4-1H-pyridone-κO:κO]
• Formula: C5 H5 Cd Cl2 N O
• Calculated formula: C5 H5 Cd Cl2 N O
• SMILES: [Cd]12([Cl][Cd]([Cl]1)[O]2=c1cc[nH]cc1)(Cl)(Cl)[O]=c1cc[nH]cc1
• Title of publication: <i>catena</i>-Poly[cadmium(II)-di-μ-chloro-μ-4-1<i>H</i>-pyridone-κ<i>O</i>:κ<i>O</i>]
• Authors of publication: Englert, Ulli; Schiffers, Stefanie
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2006
• Journal volume: 62
• Journal issue: 2
• Pages of publication: m194 - m195
• a: 7.51 ± 0.002 Å
• b: 15.531 ± 0.004 Å
• c: 6.6809 ± 0.0018 Å
• α: 90°
• β: 98.057 ± 0.005°
• γ: 90°
• Cell volume: 771.6 ± 0.4 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: I 1 2/a 1
• Hall space group symbol: -I 2ya
• Residual factor for all reflections: 0.0224
• Residual factor for significantly intense reflections: 0.0211
• Weighted residual factors for significantly intense reflections: 0.0632
• Weighted residual factors for all reflections included in the refinement: 0.0644
• Goodness-of-fit parameter for all reflections included in the refinement: 1.398
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes