Information card for entry 7156296

Structure parameters

• Formula: C20 H17 B F5 N3 O S
• Calculated formula: C20 H17 B F5 N3 O S
• Title of publication: Fluorescent boron complexes based on new N,O-chelates as promising candidates for flow cytometry.
• Authors of publication: Lugovik, Kseniya I.; Eltyshev, Alexander K.; Suntsova, Polina O.; Smoluk, Leonid T.; Belousova, Anna V.; Ulitko, Maria V.; Minin, Artem S.; Slepukhin, Pavel A.; Benassi, Enrico; Belskaya, Nataliya P.
• Journal of publication: Organic & biomolecular chemistry
• Year of publication: 2018
• Journal volume: 16
• Journal issue: 28
• Pages of publication: 5150 - 5162
• a: 17.347 ± 0.002 Å
• b: 8.8962 ± 0.0015 Å
• c: 14.148 ± 0.002 Å
• α: 90°
• β: 112.523 ± 0.014°
• γ: 90°
• Cell volume: 2016.8 ± 0.5 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 2 K
• Number of distinct elements: 7
• 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: 0.207
• Residual factor for significantly intense reflections: 0.05
• Weighted residual factors for significantly intense reflections: 0.0888
• Weighted residual factors for all reflections included in the refinement: 0.1009
• Goodness-of-fit parameter for all reflections included in the refinement: 1
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No