Information card for entry 2101041

Structure parameters

• Formula: C11 H16 N2 O2
• Calculated formula: C11 H16 N2 O2
• SMILES: CCOC(=O)/C(=C(\C=C\N(C)C)C)C#N
• Title of publication: Structural studies of `push–pull' butadienes
• Authors of publication: Dastidar, P.; Guru Row, T. N.; Venkatesan, K.
• Journal of publication: Acta Crystallographica Section B
• Year of publication: 1993
• Journal volume: 49
• Journal issue: 5
• Pages of publication: 900 - 905
• a: 7.679 ± 0.002 Å
• b: 13.368 ± 0.002 Å
• c: 11.756 ± 0.002 Å
• α: 90°
• β: 92.62 ± 0.02°
• γ: 90°
• Cell volume: 1205.5 ± 0.4 ų
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Diffraction radiation wavelength: 1.5418 Å
• Diffraction radiation type: Cu
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No