Information card for entry 2205769

Structure parameters

• Chemical name: Diiodidobis(4-methylpyridine N-oxide-?O)zinc(II)
• Formula: C12 H14 I2 N2 O2 Zn
• Calculated formula: C12 H14 I2 N2 O2 Zn
• SMILES: c1cc(C)ccn1=[O][Zn](I)(I)[O]=n1ccc(C)cc1
• Title of publication: Diiodidobis(4-methylpyridine <i>N</i>-oxide-κO)zinc(II)
• Authors of publication: Shi, Jing-Min; Liu, Zhe; Lu, Jian-Jun; Liu, Lian-Dong
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2005
• Journal volume: 61
• Journal issue: 5
• Pages of publication: m856 - m857
• a: 19.385 ± 0.005 Å
• b: 7.5134 ± 0.0019 Å
• c: 14.859 ± 0.004 Å
• α: 90°
• β: 126.487 ± 0.003°
• γ: 90°
• Cell volume: 1740 ± 0.8 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: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.036
• Residual factor for significantly intense reflections: 0.0301
• Weighted residual factors for significantly intense reflections: 0.0722
• Weighted residual factors for all reflections included in the refinement: 0.0747
• Goodness-of-fit parameter for all reflections included in the refinement: 1.036
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes