Information card for entry 8106212

Structure parameters

• Formula: C3 H3 Cl Hg N2 S2
• Calculated formula: C3 H3 Cl Hg N2 S2
• Title of publication: The crystal structure of catena-poly[chlorido-(μ2-5-methyl-1,3,4-thiadiazole-2-thiolato-κ2 S:N)mercury(II)], C3H3ClHgN2S2
• Authors of publication: Liu, Lian-Wei; Zhao, Bang-Tun
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2018
• Journal volume: 233
• Journal issue: 4
• Pages of publication: 547 - 548
• a: 18.794 ± 0.008 Å
• b: 4.0798 ± 0.0017 Å
• c: 10.093 ± 0.004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 773.9 ± 0.6 ų
• Cell temperature: 291 ± 2 K
• Ambient diffraction temperature: 291.15 K
• Number of distinct elements: 6
• Space group number: 33
• Hermann-Mauguin space group symbol: P n a 21
• Hall space group symbol: P 2c -2n
• Residual factor for all reflections: 0.0693
• Residual factor for significantly intense reflections: 0.0437
• Weighted residual factors for significantly intense reflections: 0.0922
• Weighted residual factors for all reflections included in the refinement: 0.1024
• Goodness-of-fit parameter for all reflections included in the refinement: 1.018
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No