Information card for entry 2008941

Structure parameters

• Common name: methyltriphenylphosphonium 1-thiolate-2-methyl-1,2-dicarba-closo- dodecaborane(12)
• Chemical name: methyltriphenylphosphonium 1-sulfido-2-methyl-1,2-dicarba-closo- dodecaborane(12)
• Formula: C22 H31 B10 P S
• Calculated formula: C22 H31 B10 P S
• Title of publication: Methyltriphenylphosphonium 2-methyl-1-sulfido-1,2-dicarba-<i>closo</i>-dodecaborane(12)
• Authors of publication: Kivekäs, Raikko; Benakki, Rajae; Viñas, Clara; Sillanpää, Reijo
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1999
• Journal volume: 55
• Journal issue: 9
• Pages of publication: 1581 - 1583
• a: 12.386 ± 0.003 Å
• b: 15.837 ± 0.002 Å
• c: 14.515 ± 0.003 Å
• α: 90°
• β: 105 ± 0.02°
• γ: 90°
• Cell volume: 2750.2 ± 1 ų
• Cell temperature: 294 ± 2 K
• Ambient diffraction temperature: 294 ± 2 K
• Number of distinct elements: 5
• 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: 0.172
• Residual factor for significantly intense reflections: 0.059
• Weighted residual factors for all reflections included in the refinement: 0.161
• Goodness-of-fit parameter for all reflections included in the refinement: 0.997
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No