Information card for entry 2007303

Structure parameters

• Formula: C27 H29 N3 O2
• Calculated formula: C27 H29 N3 O2
• SMILES: c12ccccc1c1c(c(c2)C=N(=O)C(C)(C)C)OC2(C=N1)N(c1c(C2(C)C)cccc1)C
• Title of publication: 5'-[2-(<i>N</i>-<i>tert</i>-Butylethanal nitrone)]-1,3,3-trimethylspiro[indoline-2,3'-naphtho[2,1-<i>b</i>][1,4]oxazine]
• Authors of publication: Luccioni-Houzé, Barbara; Giusti, Gerard; Pèpe, Gérard
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1998
• Journal volume: 54
• Journal issue: 6
• Pages of publication: 824 - 825
• a: 8.58 ± 0.001 Å
• b: 13.901 ± 0.002 Å
• c: 19.977 ± 0.003 Å
• α: 90°
• β: 98.57 ± 0.02°
• γ: 90°
• Cell volume: 2356.1 ± 0.6 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 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: 0.046
• Residual factor for significantly intense reflections: 0.036
• Weighted residual factors for all reflections: 0.066
• Weighted residual factors for significantly intense reflections: 0.065
• Goodness-of-fit parameter for all reflections: 0.923
• Goodness-of-fit parameter for significantly intense reflections: 0.991
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No