Information card for entry 7004718

Structure parameters

• Common name: (K-(2,2,2-crypt)10)(Hg3(Ge9)4)*2en*2tol
• Chemical name: [K-(2,2,2-crypt)10][Hg3(Ge9)4]*2en*2tol
• Formula: C198 H392 Ge36 Hg3 K10 N24 O60
• Calculated formula: C198 H392.04 Ge36 Hg3 K10 N24 O60
• Title of publication: [Hg3(Ge9)4]10−: a nanometric molecular rod precursor to polymeric mercury-linked cluster chains
• Authors of publication: Denning, Mark S.; Goicoechea, Jose M.
• Journal of publication: Dalton Transactions
• Year of publication: 2008
• Journal issue: 43
• Pages of publication: 5882 - 5885
• a: 14.012 ± 0.0001 Å
• b: 18.0241 ± 0.0001 Å
• c: 30.583 ± 0.0001 Å
• α: 78.5788 ± 0.0002°
• β: 88.0124 ± 0.0002°
• γ: 72.0656 ± 0.0002°
• Cell volume: 7200.17 ± 0.07 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0671
• Residual factor for significantly intense reflections: 0.0473
• Weighted residual factors for significantly intense reflections: 0.1211
• Weighted residual factors for all reflections included in the refinement: 0.1313
• Goodness-of-fit parameter for all reflections included in the refinement: 1.041
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No