Information card for entry 4023236

Structure parameters

• Formula: C22 H31 I N4 O4 Si
• Calculated formula: C22 H31 I N4 O4 Si
• Title of publication: A Regioselective Approach to Trisubstituted 2 (or 6)-Arylaminopyrimidine-5-carbaldehydes and Their Application in the Synthesis of Structurally and Electronically Unique G-C Base Precursors
• Authors of publication: Rachel L. Beingessner; Bo-Liang Deng; Phillip E. Fanwick; Hicham Fenniri
• Journal of publication: Journal of Organic Chemistry
• Year of publication: 2008
• Journal volume: 73
• Pages of publication: 931 - 939
• a: 10.3329 ± 0.0004 Å
• b: 10.5854 ± 0.0004 Å
• c: 14.1306 ± 0.0007 Å
• α: 71.8355 ± 0.0014°
• β: 77.8408 ± 0.0017°
• γ: 62.847 ± 0.003°
• Cell volume: 1302.42 ± 0.12 ų
• Cell temperature: 199 K
• Ambient diffraction temperature: 199 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for significantly intense reflections: 0.039
• Weighted residual factors for all reflections included in the refinement: 0.098
• Goodness-of-fit parameter for all reflections included in the refinement: 1.03
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MO-Kα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No