Information card for entry 7027254

Structure parameters

• Formula: C12 H11 Cl2 Hg N O S
• Calculated formula: C12 H11 Cl2 Hg N O S
• Title of publication: Pyridine-2-thione derivatives of silver(I) and mercury(II): crystal structures of dimeric [bis(diphenylphosphino)methane][(1-oxo-pyridine-2-thionato)silver(I), [2-(benzylsulfanyl)pyridine 1-oxide]dichloromercury(II) and phenyl(pyridine-2-thionato)mercury(II) †
• Authors of publication: Lobana, Tarlok S.; Paul, Seema; Castineiras, Alfonso
• Journal of publication: Journal of the Chemical Society, Dalton Transactions
• Year of publication: 1999
• Journal issue: 11
• Pages of publication: 1819
• a: 6.4265 ± 0.0005 Å
• b: 11.1825 ± 0.0011 Å
• c: 11.7128 ± 0.0009 Å
• α: 112.297 ± 0.006°
• β: 99.68 ± 0.006°
• γ: 105.797 ± 0.006°
• Cell volume: 713.7 ± 0.12 ų
• Cell temperature: 291 ± 2 K
• Ambient diffraction temperature: 291 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0469
• Residual factor for significantly intense reflections: 0.0259
• Weighted residual factors for significantly intense reflections: 0.0596
• Weighted residual factors for all reflections included in the refinement: 0.065
• Goodness-of-fit parameter for all reflections included in the refinement: 1.049
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No