Information card for entry 7116535

Structure parameters

• Formula: C38 H38 O2
• Calculated formula: C38 H38 O2
• Title of publication: Regulating the piezofluorochromism of 9,10-bis(butoxystyryl)anthracenes by isomerization of butyl groups
• Authors of publication: Yao Xiong; Xilong Yan; Yawen Ma; Yang Li; Guohui Yin; Ligong Chen
• Journal of publication: Chem.Commun.
• Year of publication: 2015
• Journal volume: 51
• Pages of publication: 3403
• a: 9.3559 ± 0.0004 Å
• b: 9.9674 ± 0.0003 Å
• c: 16.4761 ± 0.0008 Å
• α: 99.935 ± 0.003°
• β: 101.993 ± 0.004°
• γ: 96.7 ± 0.003°
• Cell volume: 1461.72 ± 0.11 ų
• Cell temperature: 100 ± 0.1 K
• Ambient diffraction temperature: 100 ± 0.1 K
• Number of distinct elements: 3
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0447
• Residual factor for significantly intense reflections: 0.0409
• Weighted residual factors for significantly intense reflections: 0.1098
• Weighted residual factors for all reflections included in the refinement: 0.1139
• Goodness-of-fit parameter for all reflections included in the refinement: 1.056
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No