Information card for entry 7057485

Structure parameters

• Formula: C24 H23 N3 O2 S
• Calculated formula: C24 H23 N3 O2 S
• Title of publication: Water switched aggregation/disaggregation strategies of a coumarin‒naphthalene conjugated sensor and its selectivity towards Cu2+ and Ag+ ions along with cell imaging studies on human osteosarcoma cells (U-2 OS)
• Authors of publication: Kumar, Ashish; Mondal, Surajit; Kayshap, Kumari Somlata; Hira, Sumit Kumar; Manna, Partha Pratim; Dehaen, Wim; Dey, Swapan
• Journal of publication: New Journal of Chemistry
• Year of publication: 2018
• Journal volume: 42
• Journal issue: 13
• Pages of publication: 10983
• a: 7.3601 ± 0.0017 Å
• b: 9.2198 ± 0.0016 Å
• c: 15.8574 ± 0.0017 Å
• α: 82.112 ± 0.012°
• β: 84.799 ± 0.015°
• γ: 82.514 ± 0.017°
• Cell volume: 1053.9 ± 0.3 ų
• Cell temperature: 293 K
• Ambient diffraction temperature: 293 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: 0.2316
• Residual factor for significantly intense reflections: 0.0905
• Weighted residual factors for significantly intense reflections: 0.1957
• Weighted residual factors for all reflections included in the refinement: 0.292
• Goodness-of-fit parameter for all reflections included in the refinement: 0.907
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No