Information card for entry 4311086

Structure parameters

• Chemical name: tris(1'-methyl(1,2-dicarba-closo- dodecaboran-1-yl))phosphine
• Formula: C9 H39 B30 P
• Calculated formula: C9 H39 B30 P
• Title of publication: Sterically Hindered and Robust Pnictogen Ligands Derived from Carboranes: Synthesis and X-ray Structure Determination of Tris(1'-methyl(1,2-dicarba-closo-dodecaboran-1-yl))phosphine, Tris(1'-methyl(1,2-dicarba-closo-dodecaboran-1-yl))arsine and Chloro(Tris(1'-methyl(1,2-dicarba-closo-dodecaboran-1-yl))phosphine)gold(I)
• Authors of publication: Arienne S. King; George Ferguson; James F. Britten; John F. Valliant
• Journal of publication: Inorganic Chemistry
• Year of publication: 2004
• Journal volume: 43
• Pages of publication: 3507 - 3513
• a: 12.251 ± 0.003 Å
• b: 12.251 ± 0.003 Å
• c: 11.514 ± 0.004 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 1496.6 ± 0.7 ų
• Cell temperature: 190 ± 2 K
• Ambient diffraction temperature: 190 ± 2 K
• Number of distinct elements: 4
• Space group number: 173
• Hermann-Mauguin space group symbol: P 63
• Hall space group symbol: P 6c
• Residual factor for all reflections: 0.0846
• Residual factor for significantly intense reflections: 0.0568
• Weighted residual factors for significantly intense reflections: 0.1216
• Weighted residual factors for all reflections included in the refinement: 0.1318
• Goodness-of-fit parameter for all reflections included in the refinement: 1.09
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No