Information card for entry 7717035

Structure parameters

• Formula: C14 H14 Br N3 O2 S
• Calculated formula: C14 H14 Br N3 O2 S
• Title of publication: Fluorophore-quencher complexes (Cu2+/Al3+) of coumarin Schiff bases as chemosensor for the detection of L-glutamic acid and L-arginine: in vitro and in vivo studies
• Authors of publication: Mohanasundaram, Ranjani; Govindan, Thiruppathi; Vasanthakumar, Keerthana; Muthusamy, Ramya; Palaniappan, Kalaivani; Subramaniam, Selvakumar; Ramasamy, Shankar; Karuppannan, Srinivasan; Sundararaj, Palanisamy; Prabhakaran, Rathinasabapathi
• Journal of publication: Dalton Transactions
• Year of publication: 2024
• a: 8.054 ± 0.0019 Å
• b: 10.596 ± 0.002 Å
• c: 10.613 ± 0.003 Å
• α: 104.764 ± 0.006°
• β: 109.118 ± 0.006°
• γ: 106.152 ± 0.006°
• Cell volume: 759.9 ± 0.3 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0688
• Residual factor for significantly intense reflections: 0.0551
• Weighted residual factors for significantly intense reflections: 0.1371
• Weighted residual factors for all reflections included in the refinement: 0.1509
• Goodness-of-fit parameter for all reflections included in the refinement: 1.041
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No