Information card for entry 2312387

Structure parameters

• Chemical name: <i>cyclo</i>-Tetrabromido-1κ^2^<i>Br</i>,3κ^2^<i>Br</i>-tetrakis(μ~2~-2-{[(pyridin-2-yl)methyl]amino}ethane-1-thiolato-κ^3^<i>N</i>,<i>S</i>:<i>S</i>)tetramercury(II)
• Formula: C32 H44 Br4 Hg4 N8 S4
• Calculated formula: C32 H44 Br4 Hg4 N8 S4
• Title of publication: Crystal structure and Hirshfeld surface analysis of <i>cyclo</i>-tetra-bromido-1κ²<i>Br</i>,3κ²<i>Br</i>-tetra-kis-(μ₂-2-{[(pyridin-2-yl)meth-yl]amino}-ethane-1-thiol-ato-κ³<i>N</i>,<i>S</i>:<i>S</i>)tetra-mercury(II).
• Authors of publication: Thomas, Isla D.; Kocher, Kathryn R.; Viehweg, Julie A.; Pike, Robert D.; Bebout, Deborah C.
• Journal of publication: Acta crystallographica. Section E, Crystallographic communications
• Year of publication: 2023
• Journal volume: 79
• Journal issue: Pt 10
• Pages of publication: 952 - 957
• a: 12.3055 ± 0.0008 Å
• b: 12.1464 ± 0.0008 Å
• c: 14.9763 ± 0.0009 Å
• α: 90°
• β: 99.509 ± 0.001°
• γ: 90°
• Cell volume: 2207.7 ± 0.2 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0183
• Residual factor for significantly intense reflections: 0.0159
• Weighted residual factors for significantly intense reflections: 0.0335
• Weighted residual factors for all reflections included in the refinement: 0.0341
• Goodness-of-fit parameter for all reflections included in the refinement: 1.183
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes