Information card for entry 2223459

Structure parameters

• Chemical name: 3-Benzyl-1-methylimidazolium picrate
• Formula: C17 H15 N5 O7
• Calculated formula: C17 H15 N5 O7
• Title of publication: 3-Benzyl-1-methylimidazolium picrate
• Authors of publication: Pi, Min; Liu, Xiu-Ling; Xu, Ji-Jun; Jin, Chuan-Ming
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2009
• Journal volume: 65
• Journal issue: 10
• Pages of publication: o2386
• a: 9.1322 ± 0.0006 Å
• b: 10.206 ± 0.0007 Å
• c: 10.8744 ± 0.0007 Å
• α: 63.619 ± 0.001°
• β: 80.166 ± 0.001°
• γ: 86.482 ± 0.001°
• Cell volume: 894.52 ± 0.1 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0737
• Residual factor for significantly intense reflections: 0.0557
• Weighted residual factors for significantly intense reflections: 0.1334
• Weighted residual factors for all reflections included in the refinement: 0.1439
• Goodness-of-fit parameter for all reflections included in the refinement: 1.04
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes