Information card for entry 4112019

Structure parameters

• Common name: Trans-DPDSB
• Chemical name: Trans,trans-2,5-Diphenyl-1,4-distyrylbenzene
• Formula: C34 H26
• Calculated formula: C34 H26
• Title of publication: Cross Dipole Stacking in the Crystal of Distyrylbenzene Derivative: The Approach toward High Solid-State Luminescence Efficiency
• Authors of publication: Zengqi Xie; Bing Yang; Feng Li; Gang Cheng; Linlin Liu; Guangdi Yang; Hai Xu; Ling Ye; Muddasir Hanif; Shiyong Liu; Dongge Ma; Yuguang Ma
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2005
• Journal volume: 127
• Pages of publication: 14152 - 14153
• a: 12.479 ± 0.004 Å
• b: 8.2482 ± 0.0002 Å
• c: 24.018 ± 0.008 Å
• α: 90°
• β: 91.22 ± 0.0009°
• γ: 90°
• Cell volume: 2471.6 ± 1.1 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Ambient diffracton pressure: 101300 kPa
• Number of distinct elements: 2
• 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: 0.2
• Residual factor for significantly intense reflections: 0.0496
• Weighted residual factors for significantly intense reflections: 0.0938
• Weighted residual factors for all reflections included in the refinement: 0.1507
• Goodness-of-fit parameter for all reflections included in the refinement: 0.979
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No