Abstract
Crystals of the title compound, C7H7NO3, under Mo Kα radiation sublime in less than 1h at room temperature. However, it was possible to collect data at 100K. It crystallized as the E isomer only. A double-bond conjugation in the furan ring is extended to the nitroalkenyl group. Molecular associations were realized in the crystal through N⋯π [3.545 (2) Å] interactions involving the furan ring and C—H⋯O hydrogen bonds.
Highlights
Crystals of the title compound, C7H7NO3, under Mo K radiation sublime in less than 1h at room temperature
It was possible to collect data at 100K. It crystallized as the E isomer only
A double-bond conjugation in the furan ring is extended to the nitroalkenyl group
Summary
Min = 0.34 e Å3 a Departamento de Ciencia de los Materiales e Ingenierıa Metalúrgica, Facultad de Ciencias, Campus Universitario del Rıo San Pedro, Puerto Real 11510, Spain, b. Centro de Bioactivos Quımicos, Universidad Central Marta Abreu de Las, Villas, Cuba, and cDepartamento de Quımica Analıtica, Facultad de Ciencias, Campus. Key indicators: single-crystal X-ray study; T = 100 K; mean (C–C) = 0.002 Å; Rfactor = 0.049; wR factor = 0.130; data-to-parameter ratio = 15.9. It was possible to collect data at 100K. It crystallized as the E isomer only. A double-bond conjugation in the furan ring is extended to the nitroalkenyl group. Molecular associations were realized in the crystal through N [3.545 (2) Å] interactions involving the furan ring and C—
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More From: Acta crystallographica. Section E, Structure reports online
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