Information card for entry 8106778

Structure parameters

• Formula: C32 H33 N11 O14
• Calculated formula: C32 H33 N11 O14
• Title of publication: Crystal structure of (E)-2-((2-(2,4-dinitrophenyl)hydrazono)methyl)-4-nitrophenol — triethylamine (2/1), C32H33N11O14
• Authors of publication: Feng, Xun; Tian, Ai-Qin; Wang, Cai-Lu; Wang, Yang
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2016
• Journal volume: 231
• Journal issue: 1
• Pages of publication: 37 - 39
• a: 12.3339 ± 0.0018 Å
• b: 37.764 ± 0.005 Å
• c: 8.2077 ± 0.0012 Å
• α: 90°
• β: 109.053 ± 0.002°
• γ: 90°
• Cell volume: 3613.5 ± 0.9 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.1816
• Residual factor for significantly intense reflections: 0.0622
• Weighted residual factors for significantly intense reflections: 0.1266
• Weighted residual factors for all reflections included in the refinement: 0.1781
• Goodness-of-fit parameter for all reflections included in the refinement: 0.962
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No