Information card for entry 8103015

Structure parameters

• Chemical name: Tetraarsenido hexamercury hexabromoindate bromide
• Formula: As4 Br7 Hg6 In
• Calculated formula: As3.924 Br6.978 Hg5.964 In
• Title of publication: Crystal structure of tetraarsenidohexamercury hexabromoindate bromide, [Hg6As4][InBr6]Br and tetraantimonidohexamercury hexabromoindate bromide, [Hg6Sb4][InBr6]Br
• Authors of publication: Hans-Jörg Deiseroth; Jens Schlirf; Christof Reiner
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2009
• Journal volume: 224
• Journal issue: 2
• Pages of publication: 167
• a: 12.3511 ± 0.0005 Å
• b: 12.3511 ± 0.0005 Å
• c: 12.3511 ± 0.0005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1884.16 ± 0.13 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• Space group number: 205
• Hermann-Mauguin space group symbol: P a -3
• Hall space group symbol: -P 2ac 2ab 3
• Residual factor for all reflections: 0.0446
• Residual factor for significantly intense reflections: 0.0325
• Weighted residual factors for significantly intense reflections: 0.0654
• Weighted residual factors for all reflections included in the refinement: 0.0697
• Goodness-of-fit parameter for all reflections included in the refinement: 1.12
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No