Information card for entry 4105037

Structure parameters

• Chemical name: 1,4-bis{(E)-1,2-bis(1,1,3,3,5,5,7,7-octaethyl-s-hydrindacen-4-yl)- phosphasileneyl}benzene
• Formula: C118 H184 P2 Si2
• Calculated formula: C118.128 H184.256 P2 Si2
• Title of publication: π-Conjugated Phosphasilenes Stabilized by Fused-Ring Bulky Groups
• Authors of publication: Baolin Li; Tsukasa Matsuo; Daisuke Hashizume; Hiroyuki Fueno; Kazuyoshi Tanaka; Kohei Tamao
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2009
• Journal volume: 131
• Pages of publication: 13222 - 13223
• a: 11.7071 ± 0.0002 Å
• b: 15.0538 ± 0.0003 Å
• c: 16.0803 ± 0.0003 Å
• α: 86.597 ± 0.001°
• β: 84.328 ± 0.001°
• γ: 68.35 ± 0.001°
• Cell volume: 2620.31 ± 0.09 ų
• Cell temperature: 140 K
• Ambient diffraction temperature: 140 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: 0.0822
• Residual factor for significantly intense reflections: 0.0556
• Weighted residual factors for significantly intense reflections: 0.1292
• Weighted residual factors for all reflections included in the refinement: 0.1518
• Goodness-of-fit parameter for all reflections included in the refinement: 1.107
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No