Information card for entry 7233497

Structure parameters

• Formula: C64 H82 N4 O2
• Calculated formula: C64 H82 N4 O2
• Title of publication: Polymorph, assembly, luminescence and semiconductor properties of a quinacridone derivative with extended pi-conjugated framework
• Authors of publication: Chenguang Wang; Dong Chen; Weiping Chen; Shanyong Chen; Kaiqi Ye; Hongyu Zhang; Jingying Zhang; Yue Wang
• Journal of publication: Journal of Materials Chemistry C
• Year of publication: 2013
• Journal volume: 1
• Pages of publication: 5548 - 5556
• a: 8.958 ± 0.006 Å
• b: 10.065 ± 0.005 Å
• c: 15.398 ± 0.008 Å
• α: 100.358 ± 0.017°
• β: 100.19 ± 0.02°
• γ: 90.81 ± 0.02°
• Cell volume: 1342.6 ± 1.3 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: 0.1069
• Residual factor for significantly intense reflections: 0.0525
• Weighted residual factors for significantly intense reflections: 0.1309
• Weighted residual factors for all reflections included in the refinement: 0.1541
• Goodness-of-fit parameter for all reflections included in the refinement: 0.917
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No