Information card for entry 4021864

Structure parameters

• Formula: C18 H21 N O6
• Calculated formula: C18 H21 N O6
• Title of publication: A Simple, Short, and Flexible Synthesis of Viridiofungin Derivatives
• Authors of publication: Stephen M. Goldup; Christopher J. Pilkington; Andrew J. P. White; Andrew Burton; Anthony G. M. Barrett
• Journal of publication: Journal of Organic Chemistry
• Year of publication: 2006
• Journal volume: 71
• Pages of publication: 6185 - 6191
• a: 5.6798 ± 0.0008 Å
• b: 14.991 ± 0.002 Å
• c: 20.777 ± 0.004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1769.1 ± 0.4 ų
• Cell temperature: 203 ± 2 K
• Ambient diffraction temperature: 203 ± 2 K
• Number of distinct elements: 4
• 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: 0.0744
• Residual factor for significantly intense reflections: 0.0688
• Weighted residual factors for all reflections: 0.1912
• Weighted residual factors for significantly intense reflections: 0.1787
• Goodness-of-fit parameter for all reflections: 1.044
• Goodness-of-fit parameter for significantly intense reflections: 1.05
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No