Information card for entry 7224698

Structure parameters

• Formula: C24 H17 N4 O3 P
• Calculated formula: C24 H17 N4 O3 P
• SMILES: P(=Nc1ccc(N(=O)=O)c2nonc12)(c1ccccc1)(c1ccccc1)c1ccccc1
• Title of publication: Synthesis in Living Cells with the Assistance of Supramolecular Nanocarriers
• Authors of publication: Shaban Ragab, Sherif; Thapaliya, Ek Raj; Zhang, Yang; Tang, Sicheng; McMahan, Jeffrey Blye; Syed, Sheyum; Captain, Burjor; Raymo, Francisco M.
• Journal of publication: RSC Adv.
• Year of publication: 2016
• a: 11.913 ± 0.0005 Å
• b: 8.4877 ± 0.0003 Å
• c: 21.1543 ± 0.0009 Å
• α: 90°
• β: 104.391 ± 0.001°
• γ: 90°
• Cell volume: 2071.88 ± 0.14 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0487
• Residual factor for significantly intense reflections: 0.0391
• Weighted residual factors for significantly intense reflections: 0.1078
• Weighted residual factors for all reflections included in the refinement: 0.1153
• Goodness-of-fit parameter for all reflections included in the refinement: 1.035
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No