Information card for entry 7101880

Structure parameters

• Formula: C46.5 H45 Cl O
• Calculated formula: C46.5 H45 Cl O
• Title of publication: An unprecedented ambipolar charge transport material exhibiting balanced electron and hole mobilities.
• Authors of publication: Liao, Yuan-Li; Lin, Chi-Yen; Liu, Yi-Hung; Wong, Ken-Tsung; Hung, Wen-Yi; Chen, Wei-Jiun
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2007
• Journal issue: 18
• Pages of publication: 1831 - 1833
• a: 21.5203 ± 0.0006 Å
• b: 10.2141 ± 0.0003 Å
• c: 16.785 ± 0.0004 Å
• α: 90°
• β: 98.044 ± 0.001°
• γ: 90°
• Cell volume: 3653.22 ± 0.17 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 2 K
• Number of distinct elements: 4
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.1307
• Residual factor for significantly intense reflections: 0.0678
• Weighted residual factors for significantly intense reflections: 0.16
• Weighted residual factors for all reflections included in the refinement: 0.1965
• Goodness-of-fit parameter for all reflections included in the refinement: 1.032
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No