Information card for entry 4349600

Structure parameters

• Formula: Cs2 Hg Se2
• Calculated formula: Cs2 Hg Se2
• SMILES: [Cs+].[Se-][Hg][Se-].[Cs+]
• Title of publication: Syntheses and properties of selenido mercurates with [HgSe2]2−anions in diverse chemical environments
• Authors of publication: Donsbach, C.; Dehnen, S.
• Journal of publication: Inorganic Chemistry Frontiers
• Year of publication: 2017
• Journal volume: 4
• Journal issue: 2
• Pages of publication: 336
• a: 8.1849 ± 0.0007 Å
• b: 10.3302 ± 0.0006 Å
• c: 4.7112 ± 0.0003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 398.34 ± 0.05 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 3
• Space group number: 55
• Hermann-Mauguin space group symbol: P b a m
• Hall space group symbol: -P 2 2ab
• Residual factor for all reflections: 0.0334
• Residual factor for significantly intense reflections: 0.0296
• Weighted residual factors for significantly intense reflections: 0.0777
• Weighted residual factors for all reflections included in the refinement: 0.08
• Goodness-of-fit parameter for all reflections included in the refinement: 1.122
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No