Information card for entry 4032637

Structure parameters

• Chemical name: 2-(5-bromothiophen-2-yl)-1,3-bis((tert-butyldimethylsilyl)oxy)- 4,4,5,5-tetramethylimidazolidine
• Formula: C23 H45 Br N2 O2 S Si2
• Calculated formula: C23 H45 Br N2 O2 S Si2
• SMILES: Brc1ccc(C2N(C(C(N2O[Si](C)(C)C(C)(C)C)(C)C)(C)C)O[Si](C)(C)C(C)(C)C)s1
• Title of publication: Mixed Phenyl and Thiophene Oligomers for Bridging Nitronyl Nitroxides.
• Authors of publication: Kolanji, Kubandiran; Ravat, Prince; Bogomyakov, Artem S.; Ovcharenko, Victor I.; Schollmeyer, Dieter; Baumgarten, Martin
• Journal of publication: The Journal of organic chemistry
• Year of publication: 2017
• a: 19.907 ± 0.002 Å
• b: 11.6503 ± 0.0009 Å
• c: 12.8343 ± 0.0012 Å
• α: 90°
• β: 99.37 ± 0.004°
• γ: 90°
• Cell volume: 2936.8 ± 0.5 ų
• Cell temperature: 193 ± 2 K
• Ambient diffraction temperature: 193 ± 2 K
• Number of distinct elements: 7
• 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: 0.085
• Residual factor for significantly intense reflections: 0.0465
• Weighted residual factors for significantly intense reflections: 0.0996
• Weighted residual factors for all reflections included in the refinement: 0.1151
• Goodness-of-fit parameter for all reflections included in the refinement: 0.943
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No