Information card for entry 2101283

Structure parameters

• Formula: C9 H14 N2 O2
• Calculated formula: C9 H14 N2 O2
• SMILES: CCCC1=CC(=O)N(C(=O)N1C)C
• Title of publication: Structure and thermochemical properties of some alkyluracils
• Authors of publication: Suwinska, K.
• Journal of publication: Acta Crystallographica Section B
• Year of publication: 1995
• Journal volume: 51
• Journal issue: 2
• Pages of publication: 248 - 254
• a: 10.738 ± 0.001 Å
• b: 11.735 ± 0.001 Å
• c: 23.056 ± 0.002 Å
• α: 90°
• β: 90.91 ± 0.02°
• γ: 90°
• Cell volume: 2904.9 ± 0.4 ų
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No