Information card for entry 4020049

Structure parameters

• Formula: C37 H45 N O7
• Calculated formula: C37 H45 N O7
• Authors of publication: Kay M. Brummond; Sang-phyo Hong
• Journal of publication: Journal of Organic Chemistry
• Year of publication: 2005
• Journal volume: 70
• Pages of publication: 907 - 916
• a: 9.1321 ± 0.0004 Å
• b: 9.1935 ± 0.0004 Å
• c: 22.2192 ± 0.001 Å
• α: 80.69 ± 0.001°
• β: 82.866 ± 0.001°
• γ: 69.114 ± 0.001°
• Cell volume: 1715.42 ± 0.13 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 4
• Space group number: 1
• Hermann-Mauguin space group symbol: P 1
• Hall space group symbol: P 1
• Residual factor for all reflections: 0.0991
• Residual factor for significantly intense reflections: 0.0632
• Weighted residual factors for significantly intense reflections: 0.1585
• Weighted residual factors for all reflections included in the refinement: 0.173
• Goodness-of-fit parameter for all reflections included in the refinement: 1.164
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No