Information card for entry 7060036

Structure parameters

• Formula: C23 H21 N3 O3 S
• Calculated formula: C23 H21 N3 O3 S
• Title of publication: A highly sensitive and selective fluorescent turn-on chemosensor bearing a 7-diethylaminocoumarin moiety for the detection of cyanide in organic and aqueous solutions
• Authors of publication: Aydıner, Burcu; Şahin, Ömer; Çakmaz, Deniz; Kaplan, Gökhan; Kaya, Kerem; Özdemir, Ümmühan Özmen; Seferoğlu, Nurgül; Seferoğlu, Zeynel
• Journal of publication: New Journal of Chemistry
• Year of publication: 2020
• Journal volume: 44
• Journal issue: 44
• Pages of publication: 19155 - 19165
• a: 8.479 ± 0.0007 Å
• b: 10.8451 ± 0.0008 Å
• c: 12.147 ± 0.001 Å
• α: 75.707 ± 0.004°
• β: 89.516 ± 0.004°
• γ: 72.029 ± 0.003°
• Cell volume: 1026.82 ± 0.14 ų
• Cell temperature: 304 ± 2 K
• Ambient diffraction temperature: 303.8 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0851
• Residual factor for significantly intense reflections: 0.0457
• Weighted residual factors for significantly intense reflections: 0.1043
• Weighted residual factors for all reflections included in the refinement: 0.119
• Goodness-of-fit parameter for all reflections included in the refinement: 1.0181
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No