Information card for entry 7202858

Structure parameters

• Common name: 4-3, 4-dicyanophenoxy-4'-dimethylaminoazobenzene(CPMAB)
• Chemical name: 4-3, 4-dicyanophenoxy-4'-dimethylaminoazobenzene(CPMAB)
• Formula: C22 H17 N5 O
• Calculated formula: C22 H17 N5 O
• SMILES: O(c1ccc(c(c1)C#N)C#N)c1ccc(N=Nc2ccc(N(C)C)cc2)cc1
• Title of publication: A non-planar organic molecule with non-volatile electrical bistability for nano-scale data storage
• Authors of publication: Hu, Junping; Li, Yingfeng; Ji, Zhuoyu; Jiang, Guiyuan; Yang, Lianming; Hu, Wenping; Gao, Hongjun; Jiang, Lei; Wen, Yongqiang; Song, Yanlin; Zhu, Daoben
• Journal of publication: Journal of Materials Chemistry
• Year of publication: 2007
• Journal volume: 17
• Journal issue: 33
• Pages of publication: 3530
• a: 7.53 ± 0.0015 Å
• b: 12.173 ± 0.002 Å
• c: 40.996 ± 0.008 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3757.8 ± 1.2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.0939
• Residual factor for significantly intense reflections: 0.0476
• Weighted residual factors for significantly intense reflections: 0.1148
• Weighted residual factors for all reflections included in the refinement: 0.1331
• Goodness-of-fit parameter for all reflections included in the refinement: 0.96
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No