Information card for entry 7114706

Structure parameters

• Chemical name: 6,9-bis(dimethylsulphide)-1,5-bis(6'-nido-decaboranyl)-arachno-decaborane
• Formula: C4 H48 B30 S2
• Calculated formula: C4 H48 B30 S2
• Title of publication: Triple linking of the decaboranyl cluster. Structure of [(SMe2)2B10H10(B10H13)2] as determined by synchrotron X-ray diffraction analysis
• Authors of publication: Bould, Jonathan; Dörfler, Udo; Thornton-Pett, Mark; Kennedy, John D.; Clegg, William; Teat, Simon J.
• Journal of publication: Chemical Communications
• Year of publication: 2001
• Journal issue: 18
• Pages of publication: 1788
• a: 13.693 ± 0.002 Å
• b: 13.823 ± 0.002 Å
• c: 17.961 ± 0.003 Å
• α: 90.469 ± 0.003°
• β: 105.008 ± 0.003°
• γ: 104.249 ± 0.003°
• Cell volume: 3173.2 ± 0.8 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0947
• Residual factor for significantly intense reflections: 0.0785
• Weighted residual factors for significantly intense reflections: 0.2037
• Weighted residual factors for all reflections included in the refinement: 0.2099
• Goodness-of-fit parameter for all reflections included in the refinement: 1.058
• Diffraction radiation wavelength: 0.6895 Å
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No