Information card for entry 4349602

Structure parameters

• Formula: Cs4 H Hg O0.5 Se4
• Calculated formula: Cs4 Hg O0.5 Se4
• 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: 10.7624 ± 0.0005 Å
• b: 8.894 ± 0.0003 Å
• c: 15.614 ± 0.0007 Å
• α: 90°
• β: 100.637 ± 0.003°
• γ: 90°
• Cell volume: 1468.9 ± 0.11 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 5
• 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: 0.0348
• Residual factor for significantly intense reflections: 0.0195
• Weighted residual factors for significantly intense reflections: 0.0242
• Weighted residual factors for all reflections included in the refinement: 0.0255
• Goodness-of-fit parameter for all reflections included in the refinement: 0.848
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No