Information card for entry 2004763

Structure parameters

• Common name: Quecksilberdiiodid.(18-Krone-6)
• Chemical name: 1,4,7,10,13,16-Hexaoxacyclooctadecan-Quecksilberdiiodid
• Formula: C12 H24 Hg I2 O6
• Calculated formula: C12 H24 Hg I2 O6
• SMILES: C1COCCOCCOCCOCCOCCO1.[Hg](I)I
• Title of publication: Verfeinerung von Quecksilberdiiodid-(18-Krone-6), Hg(18-krone-6)I~2~
• Authors of publication: El Essawi, M.; Abd El Khalik, S.; Tebbe, K.-F.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1996
• Journal volume: 52
• Journal issue: 4
• Pages of publication: 818 - 820
• a: 9.236 ± 0.002 Å
• b: 11.236 ± 0.002 Å
• c: 9.283 ± 0.002 Å
• α: 90°
• β: 90.44 ± 0.02°
• γ: 90°
• Cell volume: 963.3 ± 0.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 12
• Hermann-Mauguin space group symbol: I 1 2/m 1
• Hall space group symbol: -I 2y
• Residual factor for all reflections: 0.0203
• Residual factor for significantly intense reflections: 0.0175
• Weighted residual factors for all reflections: 0.0394
• Weighted residual factors for significantly intense reflections: 0.0388
• Goodness-of-fit parameter for all reflections: 1.068
• Goodness-of-fit parameter for significantly intense reflections: 1.106
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No