Information card for entry 2204902

Structure parameters

• Chemical name: Bis[4-trimethylammonio)phenyl] disulfide tetraiodomercurate(II)
• Formula: C18 H26 Hg I4 N2 S2
• Calculated formula: C18 H26 Hg I4 N2 S2
• SMILES: [Hg](I)(I)([I-])[I-].S(Sc1ccc([N+](C)(C)C)cc1)c1ccc([N+](C)(C)C)cc1
• Title of publication: Bis[4-(trimethylammonio)phenyl] disulfide tetraiodomercurate(II)
• Authors of publication: Chen, Jin-Xiang; Zhang, Wen-Hua; Ren, Zhi-Gang; Zhang, Yong; Lang, Jian-Ping
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2005
• Journal volume: 61
• Journal issue: 1
• Pages of publication: m60 - m62
• a: 10.4974 ± 0.0008 Å
• b: 20.3856 ± 0.0013 Å
• c: 13.2263 ± 0.001 Å
• α: 90°
• β: 95.332 ± 0.002°
• γ: 90°
• Cell volume: 2818.1 ± 0.4 ų
• Cell temperature: 193 ± 2 K
• Ambient diffraction temperature: 193 ± 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: 0.0481
• Residual factor for significantly intense reflections: 0.0405
• Weighted residual factors for significantly intense reflections: 0.0963
• Weighted residual factors for all reflections included in the refinement: 0.1008
• Goodness-of-fit parameter for all reflections included in the refinement: 1.074
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes