Information card for entry 7246151

Structure parameters

• Chemical name: tris(4-azidophenyl)methanol
• Formula: C19 H13 N9 O
• Calculated formula: C19 H13 N9 O
• SMILES: OC(c1ccc(cc1)N=N#N)(c1ccc(cc1)N=N#N)c1ccc(cc1)N=N#N
• Title of publication: Tris(4-azidophenyl)methanol – a novel and multifunctional thiol protecting group
• Authors of publication: Qiu, Xujun; Brückel, Julian; Zippel, Christoph; Nieger, Martin; Biedermann, Frank; Bräse, Stefan
• Journal of publication: RSC Advances
• Year of publication: 2023
• Journal volume: 13
• Journal issue: 4
• Pages of publication: 2483 - 2486
• a: 10.422 ± 0.003 Å
• b: 17.54 ± 0.006 Å
• c: 10.109 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1847.9 ± 1 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 4
• Space group number: 33
• Hermann-Mauguin space group symbol: P n a 21
• Hall space group symbol: P 2c -2n
• Residual factor for all reflections: 0.0463
• Residual factor for significantly intense reflections: 0.0378
• Weighted residual factors for significantly intense reflections: 0.0918
• Weighted residual factors for all reflections included in the refinement: 0.0984
• Goodness-of-fit parameter for all reflections included in the refinement: 1.029
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No