Information card for entry 2013731

Structure parameters

• Chemical name: 2,5-diphenylhydroquinone‒2-pyridone (1/2)
• Formula: C28 H24 N2 O4
• Calculated formula: C28 H21.476 N2 O4
• Title of publication: Inclusion compounds of 2,5-diphenylhydroquinone
• Authors of publication: Tali Lavy; Yana Sheynin; Moshe Kapon; Menahem Kaftory
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2004
• Journal volume: 60
• Journal issue: 1
• Pages of publication: o50 - o53
• a: 6.51 ± 0.001 Å
• b: 8.971 ± 0.001 Å
• c: 11.085 ± 0.002 Å
• α: 70.746 ± 0.002°
• β: 73.108 ± 0.002°
• γ: 73.807 ± 0.002°
• Cell volume: 572.66 ± 0.15 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.0546
• Residual factor for significantly intense reflections: 0.042
• Weighted residual factors for significantly intense reflections: 0.1187
• Weighted residual factors for all reflections included in the refinement: 0.1263
• Goodness-of-fit parameter for all reflections included in the refinement: 1.063
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No