Information card for entry 2311527

Structure parameters

• Chemical name: <i>catena</i>-Poly[[dichloridomercury(II)]-μ-bis(pyridin-3-ylmethyl)sulfane-κ^2^<i>N</i>:<i>N</i>']
• Formula: C12 H12 Cl2 Hg N2 S
• Calculated formula: C12 H12 Cl2 Hg N2 S
• Title of publication: A one-dimensional Hg^II coordination polymer based on bis-(pyridin-3-ylmeth-yl)sulfane.
• Authors of publication: Moon, Suk-Hee; Kang, Youngjin; Park, Ki-Min
• Journal of publication: Acta crystallographica. Section E, Crystallographic communications
• Year of publication: 2017
• Journal volume: 73
• Journal issue: Pt 12
• Pages of publication: 1871 - 1874
• a: 10.4724 ± 0.0011 Å
• b: 13.1128 ± 0.0014 Å
• c: 10.8914 ± 0.0012 Å
• α: 90°
• β: 100.117 ± 0.0018°
• γ: 90°
• Cell volume: 1472.4 ± 0.3 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 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: 0.0536
• Residual factor for significantly intense reflections: 0.0328
• Weighted residual factors for significantly intense reflections: 0.0694
• Weighted residual factors for all reflections included in the refinement: 0.0761
• Goodness-of-fit parameter for all reflections included in the refinement: 1.027
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No