Information card for entry 7108173

Structure parameters

• Chemical name: tetradecalithium-tetrakis[2,6-dimesitylphenyl-disulfido-silanolate] dichloride-4-n-pentane
• Formula: C116 H148 Cl2 Li14 O4 S8 Si4
• Calculated formula: C116 H148 Cl2 Li14 O4 S8 Si4
• Title of publication: A 32 vertex polyhedron via supramolecular assembly of silanedithiolate silanolate units
• Authors of publication: Stefan Spirk; Ferdinand Belaj; Natascha Hurkes; Rudolf Pietschnig
• Journal of publication: Chem.Commun.
• Year of publication: 2012
• Journal volume: 48
• Pages of publication: 8398
• a: 15.287 ± 0.003 Å
• b: 15.287 ± 0.003 Å
• c: 25.661 ± 0.005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 5997 ± 2 ų
• Cell temperature: 95 ± 2 K
• Ambient diffraction temperature: 95 ± 2 K
• Number of distinct elements: 7
• Space group number: 82
• Hermann-Mauguin space group symbol: I -4
• Hall space group symbol: I -4
• Residual factor for all reflections: 0.0814
• Residual factor for significantly intense reflections: 0.0584
• Weighted residual factors for significantly intense reflections: 0.1277
• Weighted residual factors for all reflections included in the refinement: 0.1409
• Goodness-of-fit parameter for all reflections included in the refinement: 1.007
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No