Information card for entry 7130556

Structure parameters

• Formula: C35 H24 N2 O
• Calculated formula: C35 H24 N2 O
• Title of publication: Phosphine-Mediated Three-Component Bioconjugation of Amino- and Azidosaccharides in Ionic Liquids
• Authors of publication: Ohata, Jun; Hall, Yvonne D. D.; Uzoewulu, Chiamaka; Nizam, Zeinab M.; Ishizawa, Seiya; El-Shaffey, Hisham
• Journal of publication: Chemical Communications
• Year of publication: 2022
• a: 35.8398 ± 0.0012 Å
• b: 4.6033 ± 0.0001 Å
• c: 15.1676 ± 0.0005 Å
• α: 90°
• β: 112.825 ± 0.002°
• γ: 90°
• Cell volume: 2306.42 ± 0.12 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 4
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0792
• Residual factor for significantly intense reflections: 0.0643
• Weighted residual factors for all reflections: 0.1829
• Weighted residual factors for significantly intense reflections: 0.1625
• Weighted residual factors for all reflections included in the refinement: 0.1829
• Goodness-of-fit parameter for all reflections included in the refinement: 1.0249
• Diffraction radiation wavelength: 1.5418 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No