Information card for entry 7029665

Structure parameters

• Formula: C20 H21 N3 O2
• Calculated formula: C20 H21 N3 O2
• SMILES: c1(ccccc1)C(=O)NN=Cc1c(c2CCCN3CCCc(c1)c23)O
• Title of publication: A new multifunctional Schiff base as a fluorescence sensor for Al(3+) and a colorimetric sensor for CN(-) in aqueous media: an application to bioimaging.
• Authors of publication: Lee, Seul Ah; You, Ga Rim; Choi, Ye Won; Jo, Hyun Yong; Kim, Ah Ram; Noh, Insup; Kim, Sung-Jin; Kim, Youngmee; Kim, Cheal
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2014
• Journal volume: 43
• Journal issue: 18
• Pages of publication: 6650 - 6659
• a: 12.835 ± 0.003 Å
• b: 9.381 ± 0.0019 Å
• c: 28.713 ± 0.006 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3457.2 ± 1.3 ų
• Cell temperature: 170 ± 2 K
• Ambient diffraction temperature: 170 ± 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: 0.1587
• Residual factor for significantly intense reflections: 0.0607
• Weighted residual factors for significantly intense reflections: 0.1328
• Weighted residual factors for all reflections included in the refinement: 0.1596
• Goodness-of-fit parameter for all reflections included in the refinement: 0.769
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No