Information card for entry 7122741

Structure parameters

• Common name: trialkyl diazido oxime
• Chemical name: 2-Azido-N-(6-azidohexyl)-N-(3-(2-(hydroxyimino)acetyl)phenyl)acetamide
• Formula: C16 H20 N8 O3
• Calculated formula: C16 H20 N8 O3
• Title of publication: Site-Selective Conversion of Azido Groups at Carbonyl α-Positions into Oxime Groups Leading Triazide to Triple Click Conjugation Scaffold
• Authors of publication: Yokoi, Taiki; Ueda, Tomomi; Tanimoto, Hiroki; Morimoto, Tsumoru; Kakiuchi, Kiyomi
• Journal of publication: Chemical Communications
• Year of publication: 2018
• a: 13.5247 ± 0.0004 Å
• b: 7.64772 ± 0.00017 Å
• c: 17.748 ± 0.0005 Å
• α: 90°
• β: 97.938 ± 0.007°
• γ: 90°
• Cell volume: 1818.14 ± 0.09 ų
• Cell temperature: 123 K
• Ambient diffraction temperature: 123 K
• Number of distinct elements: 4
• 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: 0.0454
• Residual factor for significantly intense reflections: 0.0359
• Weighted residual factors for significantly intense reflections: 0.0783
• Weighted residual factors for all reflections included in the refinement: 0.0822
• Goodness-of-fit parameter for all reflections included in the refinement: 1.046
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No