Information card for entry 2202709

Structure parameters

• Chemical name: 2,4-Di(butylureido)-6-methyl-s-triazine
• Formula: C14 H25 N7 O2
• Calculated formula: C14 H25 N7 O2
• Title of publication: 2,4-Di(butylureido)-6-methyl-<i>s</i>-triazine
• Authors of publication: Kooijman, Huub; Spek, Anthony L.; Beijer, Felix H.; Sijbesma, Rint P.; Meijer, E.W.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2003
• Journal volume: 59
• Journal issue: 10
• Pages of publication: o1546 - o1548
• a: 29.54 ± 0.02 Å
• b: 4.613 ± 0.005 Å
• c: 26.89 ± 0.02 Å
• α: 90°
• β: 109.34 ± 0.07°
• γ: 90°
• Cell volume: 3457 ± 5 ų
• Cell temperature: 150 K
• Ambient diffraction temperature: 150 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: 0.2296
• Residual factor for significantly intense reflections: 0.0766
• Weighted residual factors for significantly intense reflections: 0.1333
• Weighted residual factors for all reflections included in the refinement: 0.1869
• Goodness-of-fit parameter for all reflections included in the refinement: 1.113
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes