Information card for entry 2232924

Structure parameters

• Chemical name: 2-[2-(2-Hydroxyethoxy)phenyl]-4,4,5,5-tetramethyl-2-imidazoline-1-oxyl 3-oxide
• Formula: C15 H21 N2 O4
• Calculated formula: C15 H21 N2 O4
• SMILES: C1(C(C)(C)N(=C(c2ccccc2OCCO)[N]1=O)=O)(C)C
• Title of publication: 2-[2-(2-Hydroxyethoxy)phenyl]-4,4,5,5-tetramethyl-2-imidazoline-1-oxyl 3-oxide
• Authors of publication: Jing, Lin-Lin; Ma, Hui-Ping; He, Lei; Fan, Peng-Cheng; Jia, Zheng-Ping
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2011
• Journal volume: 67
• Journal issue: 12
• Pages of publication: o3503
• a: 14.458 ± 0.007 Å
• b: 10.187 ± 0.005 Å
• c: 10.67 ± 0.005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1571.5 ± 1.3 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 4
• Space group number: 29
• Hermann-Mauguin space group symbol: P c a 21
• Hall space group symbol: P 2c -2ac
• Residual factor for all reflections: 0.0572
• Residual factor for significantly intense reflections: 0.0422
• Weighted residual factors for significantly intense reflections: 0.0976
• Weighted residual factors for all reflections included in the refinement: 0.1068
• Goodness-of-fit parameter for all reflections included in the refinement: 1.048
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes