Information card for entry 7234510

Structure parameters

• Formula: C28 H34 N4 O4
• Calculated formula: C28 H34 N4 O4
• Title of publication: Controllable molecular aggregation and fluorescence properties of 1,3,4-oxadiazole derivatives
• Authors of publication: Haitao Wang; Fangyi Chen; Xiaoshi Jia; Huimin Liu; Xia Ran; Mahesh Kumar Ravva; Fu-Quan Bai; Songnan Qu; Min Li; Hong-Xing Zhang; Jean-Luc Bredas
• Journal of publication: Journal of Materials Chemistry C
• Year of publication: 2015
• Journal volume: 3
• Pages of publication: 11681 - 11688
• a: 8.134 ± 0.006 Å
• b: 8.142 ± 0.007 Å
• c: 10.657 ± 0.012 Å
• α: 110.13 ± 0.04°
• β: 93 ± 0.04°
• γ: 98.55 ± 0.03°
• Cell volume: 651.2 ± 1.1 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 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: 0.0883
• Residual factor for significantly intense reflections: 0.0507
• Weighted residual factors for significantly intense reflections: 0.1281
• Weighted residual factors for all reflections included in the refinement: 0.1432
• Goodness-of-fit parameter for all reflections included in the refinement: 1.006
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No