Information card for entry 1575323

Structure parameters

• Common name: MO1-05D from Acetone/heptane all-para-O2NC6H4SO2NHC6H4OMe
• Formula: C13 H12 N2 O5 S
• Calculated formula: C13 H12 N2 O5 S
• Title of publication: Structural Comparison of Three N-(4-Methoxyphenyl)-Nitrobenzenesulfonamide Derivatives
• Authors of publication: Oblazny, Mark; Hamaker, Christhoper G.
• Journal of publication: Crystals
• Year of publication: 2025
• Journal volume: 15
• Journal issue: 8
• Pages of publication: 673
• a: 5.171 ± 0.0004 Å
• b: 12.9028 ± 0.001 Å
• c: 19.7324 ± 0.0015 Å
• α: 90°
• β: 94.42 ± 0.004°
• γ: 90°
• Cell volume: 1312.64 ± 0.18 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 9
• Hermann-Mauguin space group symbol: C 1 c 1
• Hall space group symbol: C -2yc
• Residual factor for all reflections: 0.0302
• Residual factor for significantly intense reflections: 0.0301
• Weighted residual factors for significantly intense reflections: 0.0905
• Weighted residual factors for all reflections included in the refinement: 0.0905
• Goodness-of-fit parameter for all reflections included in the refinement: 1.156
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No