Information card for entry 3000576

Structure parameters

• Chemical name: 6-((4'-nitro-[1,1' biphenyl]-4-yl)oxy)hexanoic acid (NO2-Bi-5-S)
• Formula: C36 H38 N2 O10
• Authors of publication: Zugenmaier
• Journal of publication: To be published in Crystals
• a: 8.407 ± 0.005 Å
• b: 12.1 ± 0.006 Å
• c: 17.651 ± 0.009 Å
• α: 77.36 ± 0.04°
• β: 79.82 ± 0.04°
• γ: 74.59 ± 0.04°
• Cell volume: 1675.6 ± 1.6 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1094
• Residual factor for significantly intense reflections: 0.0647
• Weighted residual factors for significantly intense reflections: 0.1626
• Weighted residual factors for all reflections included in the refinement: 0.191
• Goodness-of-fit parameter for all reflections included in the refinement: 1.039
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: No
• Has disorder: No
• Has Fobs: No