Information card for entry 7223062

Structure parameters

• Formula: C13 H14 N2 O2
• Calculated formula: C13 H14 N2 O2
• SMILES: O=C1N(C(=O)C=C1Nc1ccccc1)CCC
• Title of publication: Effect of Alkyl Groups on Emission Properties of Aggregation Induced Emission Active N-Alkyl Arylaminomaleimide Dyes
• Authors of publication: Imoto, Hiroaki; Nohmi, Katsuya; Kizaki, Kohei; Watase, Seiji; Matsukawa, Kimihiro; Yamamoto, Shunsuke; Mitsuishi, Masaya; Naka, Kensuke
• Journal of publication: RSC Adv.
• Year of publication: 2015
• a: 5.1865 ± 0.0007 Å
• b: 9.3655 ± 0.0013 Å
• c: 13.2474 ± 0.0017 Å
• α: 73.44 ± 0.003°
• β: 81.546 ± 0.003°
• γ: 77.431 ± 0.003°
• Cell volume: 599.52 ± 0.14 ų
• Cell temperature: 296 K
• Ambient diffraction temperature: 296 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 significantly intense reflections: 0.0586
• Weighted residual factors for all reflections included in the refinement: 0.1692
• Goodness-of-fit parameter for all reflections included in the refinement: 1.001
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No