Information card for entry 7130588

Structure parameters

• Formula: C22 H17 F N4 O
• Calculated formula: C22 H17 F N4 O
• Title of publication: Tetrazole-ene Photoactivatable Fluorophore with Improved Brightness and Stability in Protic Solution
• Authors of publication: Zhang, Yi-Kang; Li, Meng; Ruan, Lan; An, Peng
• Journal of publication: Chemical Communications
• Year of publication: 2022
• a: 5.5665 ± 0.0003 Å
• b: 23.9215 ± 0.0016 Å
• c: 13.9094 ± 0.0009 Å
• α: 90°
• β: 91.355 ± 0.003°
• γ: 90°
• Cell volume: 1851.6 ± 0.2 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.1634
• Residual factor for significantly intense reflections: 0.0777
• Weighted residual factors for significantly intense reflections: 0.1981
• Weighted residual factors for all reflections included in the refinement: 0.2642
• Goodness-of-fit parameter for all reflections included in the refinement: 1.038
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No