Information card for entry 7121903

Structure parameters

• Formula: Hg Na7 S12 Sb5
• Calculated formula: Hg1.02 Na7 S12 Sb4.98
• Title of publication: Remarkable multimember-ring configurations in a new family of Na₇M^IISb₅S₁₂ (M^II = Zn, Cd, Hg) exhibiting various three-dimensional tunnel structures.
• Authors of publication: Wu, Kui; Zhang, Bingbing; Yang, Zhihua; Pan, Shilie
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2018
• Journal volume: 54
• Journal issue: 59
• Pages of publication: 8269 - 8272
• a: 14.537 ± 0.009 Å
• b: 14.537 ± 0.009 Å
• c: 9.815 ± 0.013 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 1796 ± 3 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 4
• Space group number: 148
• Hermann-Mauguin space group symbol: R -3 :H
• Hall space group symbol: -R 3
• Residual factor for all reflections: 0.0408
• Residual factor for significantly intense reflections: 0.0355
• Weighted residual factors for significantly intense reflections: 0.0849
• Weighted residual factors for all reflections included in the refinement: 0.0882
• Goodness-of-fit parameter for all reflections included in the refinement: 1.123
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No