Information card for entry 2224834

Structure parameters

• Chemical name: 2-[2-(Trimethylsilyl)ethyl]isoindoline-1,3-dione
• Formula: C13 H17 N O2 Si
• Calculated formula: C13 H17 N O2 Si
• SMILES: [Si](C)(C)(C)CCN1C(=O)c2ccccc2C1=O
• Title of publication: 2-[2-(Trimethylsilyl)ethyl]isoindoline-1,3-dione
• Authors of publication: Guzei, Ilia A.; Spencer, Lara C.; Zakai, Uzma I.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2010
• Journal volume: 66
• Journal issue: 1
• Pages of publication: o223 - o224
• a: 11.562 ± 0.005 Å
• b: 6.411 ± 0.002 Å
• c: 19.445 ± 0.008 Å
• α: 90°
• β: 95.176 ± 0.014°
• γ: 90°
• Cell volume: 1435.5 ± 1 ų
• Cell temperature: 300 ± 2 K
• Ambient diffraction temperature: 300 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0743
• Residual factor for significantly intense reflections: 0.0437
• Weighted residual factors for significantly intense reflections: 0.1269
• Weighted residual factors for all reflections included in the refinement: 0.1512
• Goodness-of-fit parameter for all reflections included in the refinement: 0.992
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: Mo-Kα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes