Information card for entry 2231907

Structure parameters

• Chemical name: 1,1'-(Propane-1,3-diyl)bis(3-phenylurea)
• Formula: C17 H20 N4 O2
• Calculated formula: C17 H20 N4 O2
• Title of publication: 1,1'-(Propane-1,3-diyl)bis(3-phenylurea)
• Authors of publication: Pansuriya, Pramod; Naidu, Hariska; Friedrich, Holger B.; Maguire, Glenn E. M.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2011
• Journal volume: 67
• Journal issue: 10
• Pages of publication: o2552
• a: 33.811 ± 0.007 Å
• b: 4.598 ± 0.001 Å
• c: 9.891 ± 0.002 Å
• α: 90°
• β: 98.957 ± 0.004°
• γ: 90°
• Cell volume: 1518.9 ± 0.6 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 4
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0356
• Residual factor for significantly intense reflections: 0.0327
• Weighted residual factors for significantly intense reflections: 0.0899
• Weighted residual factors for all reflections included in the refinement: 0.0924
• Goodness-of-fit parameter for all reflections included in the refinement: 1.051
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes