Information card for entry 3000573

Structure parameters

• Chemical name: 4-((4'-nitro-[1,1' biphenyl]-4-yl)oxy)butanoic acid N,N-dimethylacetamide (NO2-Bi-3-S-DMAc)
• Formula: C20 H24 N2 O6
• Authors of publication: Zugenmaier
• Journal of publication: To be published in Crystals
• a: 11.265 ± 0.003 Å
• b: 6.999 ± 0.002 Å
• c: 13.202 ± 0.004 Å
• α: 90°
• β: 108.08 ± 0.02°
• γ: 90°
• Cell volume: 989.5 ± 0.5 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.0433
• Residual factor for significantly intense reflections: 0.0355
• Weighted residual factors for significantly intense reflections: 0.0923
• Weighted residual factors for all reflections included in the refinement: 0.0973
• Goodness-of-fit parameter for all reflections included in the refinement: 1.064
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: No
• Has disorder: No
• Has Fobs: No