Information card for entry 4516775

Structure parameters

• Common name: azide_4c
• Chemical name: azide_4c
• Formula: C22 H26 N6 O7
• Calculated formula: C22 H26 N6 O7
• Title of publication: Late Stage Azidation of Complex Molecules.
• Authors of publication: Karimov, Rashad R.; Sharma, Ankit; Hartwig, John F.
• Journal of publication: ACS central science
• Year of publication: 2016
• Journal volume: 2
• Journal issue: 10
• Pages of publication: 715 - 724
• a: 8.1836 ± 0.0002 Å
• b: 10.5248 ± 0.0002 Å
• c: 13.9957 ± 0.0003 Å
• α: 90°
• β: 103.058 ± 0.001°
• γ: 90°
• Cell volume: 1174.29 ± 0.04 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 2 K
• Number of distinct elements: 4
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.0439
• Residual factor for significantly intense reflections: 0.0387
• Weighted residual factors for significantly intense reflections: 0.0963
• Weighted residual factors for all reflections included in the refinement: 0.1005
• Goodness-of-fit parameter for all reflections included in the refinement: 1.043
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No