Information card for entry 4128793

Structure parameters

• Formula: C37 H48 N4 O4 S Si
• Calculated formula: C37 H48 N4 O4 S Si
• Title of publication: Total Synthesis and Anti-Cancer Activity of All Known Communesin Alkaloids and Related Derivatives.
• Authors of publication: Pompeo, Matthew M.; Cheah, Jaime H.; Movassaghi, Mohammad
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2019
• Journal volume: 141
• Journal issue: 36
• Pages of publication: 14411 - 14420
• a: 7.8618 ± 0.0001 Å
• b: 17.7249 ± 0.0003 Å
• c: 27.6554 ± 0.0005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3853.77 ± 0.11 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0332
• Residual factor for significantly intense reflections: 0.0312
• Weighted residual factors for significantly intense reflections: 0.0827
• Weighted residual factors for all reflections included in the refinement: 0.0843
• Goodness-of-fit parameter for all reflections included in the refinement: 1.061
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No