Information card for entry 2235967

Structure parameters

• Chemical name: Diiodido[methyl 2-(quinolin-8-yloxy)acetate-κ<i>N</i>]mercury(II)
• Formula: C12 H11 Hg I2 N O3
• Calculated formula: C12 H11 Hg I2 N O3
• SMILES: [Hg](I)(I)[n]1cccc2cccc(OCC(=O)OC)c12
• Title of publication: Diiodido[methyl 2-(quinolin-8-yloxy)acetate-κ<i>N</i>]mercury(II)
• Authors of publication: Wang, Yu-Hong; Zhong, Qin; Song, Rui-Feng
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2012
• Journal volume: 68
• Journal issue: 8
• Pages of publication: m1057
• a: 7.5889 ± 0.0005 Å
• b: 10.367 ± 0.0007 Å
• c: 11.4241 ± 0.0011 Å
• α: 72.203 ± 0.018°
• β: 74.4 ± 0.02°
• γ: 68.644 ± 0.019°
• Cell volume: 784.32 ± 0.16 ų
• Cell temperature: 223 ± 2 K
• Ambient diffraction temperature: 223 ± 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: 0.0541
• Residual factor for significantly intense reflections: 0.045
• Weighted residual factors for significantly intense reflections: 0.0952
• Weighted residual factors for all reflections included in the refinement: 0.1041
• Goodness-of-fit parameter for all reflections included in the refinement: 1.079
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes