Information card for entry 4332671

Structure parameters

• Formula: C22 H26 Au2 Hg N6 S2
• Calculated formula: C22 H26 Au2 Hg N6 S2
• SMILES: c1(ccc(cc1)[N+](C)(C)C)S[Hg]Sc1ccc(cc1)[N+](C)(C)C.N#C[Au]C#N.[Au](C#N)C#N
• Title of publication: Toward Rational Construction of Gold, Gold−Silver, and Gold−Mercury String Complexes: Syntheses, Structures, and Properties of [Au(Tab)2]2L2(L = I and PF6), {[(Tab)2M][Au(CN)2]}2(M = Au and Ag), and {[Hg(Tab)2][Au(CN)2]2} [Tab = 4-(Trimethylammonio)benzenethiolate]
• Authors of publication: Chen, Jin-Xiang; Zhang, Wen-Hua; Tang, Xiao-Yan; Ren, Zhi-Gang; Li, Hong-Xi; Zhang, Yong; Lang, Jian-Ping
• Journal of publication: Inorganic Chemistry
• Year of publication: 2006
• Journal volume: 45
• Journal issue: 19
• Pages of publication: 7671 - 7680
• a: 17.113 ± 0.002 Å
• b: 9.919 ± 0.0012 Å
• c: 15.473 ± 0.002 Å
• α: 90°
• β: 92.422 ± 0.003°
• γ: 90°
• Cell volume: 2624.1 ± 0.6 ų
• Cell temperature: 193 ± 2 K
• Ambient diffraction temperature: 193 ± 2 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0338
• Residual factor for significantly intense reflections: 0.0295
• Weighted residual factors for significantly intense reflections: 0.0708
• Weighted residual factors for all reflections included in the refinement: 0.0738
• Goodness-of-fit parameter for all reflections included in the refinement: 0.953
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No