Information card for entry 1569101

Structure parameters

• Chemical name: MR-360
• Formula: C30 H58 N6 S2 Si
• Calculated formula: C30 H58 N6 S2 Si
• a: 14.2995 ± 0.0007 Å
• b: 19.0824 ± 0.0006 Å
• c: 26.3974 ± 0.0008 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 7203 ± 0.5 ų
• Cell temperature: 123 K
• Ambient diffraction temperature: 123 ± 2 K
• Number of distinct elements: 5
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.0893
• Residual factor for significantly intense reflections: 0.058
• Weighted residual factors for significantly intense reflections: 0.1469
• Weighted residual factors for all reflections included in the refinement: 0.162
• Goodness-of-fit parameter for all reflections included in the refinement: 0.931
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No