Information card for entry 7027321

Structure parameters

• Formula: C79 H78 Hg3 O12 P6 S4
• Calculated formula: C79 H78 Hg3 O12 P6 S4
• Title of publication: Host‒guest chemistry of the cluster [Hg3(μ-dppm)3]4+ [dppm = bis(diphenylphosphino)methane] with oxo- and fluoro-anions
• Authors of publication: Knoepfler-Mühlecker, Anna; Scheffter, Birgit; Kopacka, Holger; Wurst, Klaus; Peringer, Paul
• Journal of publication: Journal of the Chemical Society, Dalton Transactions
• Year of publication: 1999
• Journal issue: 15
• Pages of publication: 2525
• a: 23.95 ± 0.002 Å
• b: 21.752 ± 0.003 Å
• c: 19.594 ± 0.003 Å
• α: 90°
• β: 111.13 ± 0.01°
• γ: 90°
• Cell volume: 9521 ± 2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.1187
• Residual factor for significantly intense reflections: 0.0628
• Weighted residual factors for all reflections: 0.181
• Weighted residual factors for significantly intense reflections: 0.1436
• Goodness-of-fit parameter for all reflections: 1.04
• Goodness-of-fit parameter for significantly intense reflections: 1.128
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No