Information card for entry 7720035

Structure parameters

• Chemical name: bis(tetraethylammonium) tetrakis(4-methylbenzene-1-thiolato)-mercury(ii)
• Formula: C35 H51 Hg N5 O2 S2
• Calculated formula: C35 H51 Hg N5 O2 S2
• Title of publication: Sulfur insertion into group 12 metal dithiolate complexes: metal-dependent equilibria.
• Authors of publication: Sohail, Muhammad; Heinsen, Carsten; Oliver, Allen G.; Tsui, Emily Y.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2026
• Journal volume: 55
• Journal issue: 10
• Pages of publication: 4119 - 4127
• a: 9.5352 ± 0.0006 Å
• b: 15.4127 ± 0.0008 Å
• c: 24.2083 ± 0.0015 Å
• α: 90°
• β: 90.247 ± 0.002°
• γ: 90°
• Cell volume: 3557.7 ± 0.4 ų
• Cell temperature: 120 K
• Ambient diffraction temperature: 120 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: 0.0557
• Residual factor for significantly intense reflections: 0.0319
• Weighted residual factors for significantly intense reflections: 0.0526
• Weighted residual factors for all reflections included in the refinement: 0.0588
• Goodness-of-fit parameter for all reflections included in the refinement: 1.023
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No