Information card for entry 2216892

Structure parameters

• Chemical name: <i>N</i>-Phenyl-<i>N</i>-{4-[5-(4-pyridyl)-1,3,4-oxadiazol-2-yl]phenyl}aniline
• Formula: C25 H18 N4 O
• Calculated formula: C25 H18 N4 O
• SMILES: c1cc(ccn1)c1nnc(c2ccc(cc2)N(c2ccccc2)c2ccccc2)o1
• Title of publication: <i>N</i>-Phenyl-<i>N</i>-{4-[5-(4-pyridyl)-1,3,4-oxadiazol-2-yl]phenyl}aniline
• Authors of publication: Li-Ping Han; Bin Li; Jie Liu
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2008
• Journal volume: 64
• Journal issue: 1
• Pages of publication: o242 - o242
• a: 10.7125 ± 0.0009 Å
• b: 14.1797 ± 0.0012 Å
• c: 12.7835 ± 0.0011 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1941.8 ± 0.3 ų
• Cell temperature: 291 ± 2 K
• Ambient diffraction temperature: 291 ± 2 K
• Number of distinct elements: 4
• Space group number: 33
• Hermann-Mauguin space group symbol: P n a 21
• Hall space group symbol: P 2c -2n
• Residual factor for all reflections: 0.0525
• Residual factor for significantly intense reflections: 0.04
• Weighted residual factors for significantly intense reflections: 0.078
• Weighted residual factors for all reflections included in the refinement: 0.0825
• Goodness-of-fit parameter for all reflections included in the refinement: 0.991
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes