Information card for entry 1514777

Structure parameters

• Formula: C32.33 H36.66 Cl0.66 N4 O10 S Si
• Calculated formula: C32.3305 H36.661 Cl0.661 N4 O10 S Si
• Title of publication: Concise Total Synthesis of (+)-Bionectins A and C.
• Authors of publication: Coste, Alexis; Kim, Justin; Adams, Timothy C.; Movassaghi, Mohammad
• Journal of publication: Chemical science (Royal Society of Chemistry : 2010)
• Year of publication: 2013
• Journal volume: 4
• Journal issue: 8
• Pages of publication: 3191 - 3197
• a: 13.7346 ± 0.001 Å
• b: 16.0038 ± 0.0011 Å
• c: 17.3585 ± 0.0013 Å
• α: 100.01 ± 0.001°
• β: 92.214 ± 0.001°
• γ: 108.59 ± 0.001°
• Cell volume: 3543.2 ± 0.4 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 7
• Space group number: 1
• Hermann-Mauguin space group symbol: P 1
• Hall space group symbol: P 1
• Residual factor for all reflections: 0.094
• Residual factor for significantly intense reflections: 0.0751
• Weighted residual factors for significantly intense reflections: 0.2013
• Weighted residual factors for all reflections included in the refinement: 0.2202
• Goodness-of-fit parameter for all reflections included in the refinement: 1.03
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No