Information card for entry 2214298

Structure parameters

• Chemical name: Imipraminium picrate
• Formula: C25 H27 N5 O7
• Calculated formula: C25 H27 N5 O7
• SMILES: c12ccccc1CCc1ccccc1N2CCC[NH+](C)C.c1([O-])c(cc(cc1N(=O)=O)N(=O)=O)N(=O)=O
• Title of publication: Imipraminium picrate
• Authors of publication: Harrison, William T. A.; Bindya, S.; Ashok, M. A.; Yathirajan, H. S.; Narayana, B.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 7
• Pages of publication: o3143 - o3143
• a: 10.5204 ± 0.001 Å
• b: 10.6661 ± 0.001 Å
• c: 11.7603 ± 0.0011 Å
• α: 77.292 ± 0.001°
• β: 73.862 ± 0.001°
• γ: 84.59 ± 0.001°
• Cell volume: 1235.8 ± 0.2 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 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: 0.0916
• Residual factor for significantly intense reflections: 0.049
• Weighted residual factors for significantly intense reflections: 0.1113
• Weighted residual factors for all reflections included in the refinement: 0.1273
• Goodness-of-fit parameter for all reflections included in the refinement: 0.948
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes