Information card for entry 2006034

Structure parameters

• Chemical name: bis[1-methyl-3-(2-propenyl)-2(3H)-imidazolethione]dichlorozinc(II)
• Formula: C14 H20 Cl2 N4 S2 Zn
• Calculated formula: C14 H20 Cl2 N4 S2 Zn
• Title of publication: Dichlorobis[1-methyl-3-(prop-2-enyl)imidazole-2(3<i>H</i>)-thione-<i>S</i>]zinc(II)
• Authors of publication: Williams, D. J.; Ly, T. A.; Mudge, J. W.; Pennington, W. T.; Schimek, G. L.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1997
• Journal volume: 53
• Journal issue: 4
• Pages of publication: 415 - 416
• a: 14.0082 ± 0.0008 Å
• b: 10.803 ± 0.001 Å
• c: 14.581 ± 0.001 Å
• α: 90°
• β: 116.625 ± 0.008°
• γ: 90°
• Cell volume: 1972.6 ± 0.3 ų
• Cell temperature: 295 K
• Ambient diffraction temperature: 295 K
• Number of distinct elements: 6
• 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: 0.0626
• Residual factor for significantly intense reflections: 0.043
• Weighted residual factors for all reflections: 0.0431
• Weighted residual factors for significantly intense reflections: 0.044
• Goodness-of-fit parameter for significantly intense reflections: 1.85
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No