Information card for entry 4023923

Structure parameters

• Formula: C16 H20 O5
• Calculated formula: C16 H17 O5
• Title of publication: Chemoselective Conjugate Addition of Dimethylzinc-Mediated Ether and Acetal Radicals to Alkylidenemalonates and Asymmetric Reactions
• Authors of publication: Ken-ichi Yamada; Masaru Maekawa; Tito Akindele; Mayu Nakano; Yasutomo Yamamoto; Kiyoshi Tomioka
• Journal of publication: Journal of Organic Chemistry
• Year of publication: 2008
• Journal volume: 73
• Pages of publication: 9535 - 9538
• a: 10.676 ± 0.012 Å
• b: 8.688 ± 0.012 Å
• c: 16.49 ± 0.02 Å
• α: 90°
• β: 101.32 ± 0.04°
• γ: 90°
• Cell volume: 1500 ± 3 ų
• Cell temperature: 93.1 K
• Number of distinct elements: 3
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for significantly intense reflections: 0.055
• Weighted residual factors for all reflections included in the refinement: 0.125
• Goodness-of-fit parameter for all reflections included in the refinement: 1.027
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No