Information card for entry 4325352

Structure parameters

• Formula: C6 H11 Cl3 N2 Zn
• Calculated formula: C6 H11 Cl3 N2 Zn
• Title of publication: Validation of Speciation Techniques: A Study of Chlorozincate(II) Ionic Liquids
• Authors of publication: Julien Estager; Peter Nockemann; Kenneth R. Seddon; Małgorzata Swadźba-Kwaśny; Sophie Tyrrell
• Journal of publication: Inorganic Chemistry
• Year of publication: 2011
• Journal volume: 50
• Pages of publication: 5258 - 5271
• a: 7.7175 ± 0.0001 Å
• b: 17.1624 ± 0.0005 Å
• c: 8.8476 ± 0.0002 Å
• α: 90°
• β: 109.393 ± 0.002°
• γ: 90°
• Cell volume: 1105.38 ± 0.05 ų
• Cell temperature: 120 K
• Ambient diffraction temperature: 120 K
• Number of distinct elements: 5
• 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: 0.0284
• Residual factor for significantly intense reflections: 0.022
• Weighted residual factors for significantly intense reflections: 0.068
• Weighted residual factors for all reflections included in the refinement: 0.0923
• Goodness-of-fit parameter for all reflections included in the refinement: 1.389
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MOKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No