(E)-Ethyl 2-cyano-3-(furan-2-yl)acrylate

Area of Science:

• Crystallography
• Molecular structure analysis
• Organic chemistry

Background:

• Understanding molecular arrangements is crucial in chemistry.
• Crystal packing influences material properties.
• Intermolecular forces dictate solid-state structures.

Purpose of the Study:

• To elucidate the crystal structure of the title compound, C(10)H(9)NO(3).
• To analyze the molecular conformation and intermolecular interactions in the solid state.

Main Methods:

• Single-crystal X-ray diffraction was employed.
• Analysis of atomic positions and bond lengths.
• Identification of hydrogen bonding and other non-covalent interactions.

Main Results:

• Two independent molecules of C(10)H(9)NO(3) were identified in the asymmetric unit.
• Non-hydrogen atoms in both molecules exhibit near-planar geometry.
• Inversion dimers formed by C-H⋯O interactions link the molecules, creating R(2)(2)(10) ring motifs.

Conclusions:

• The crystal structure of C(10)H(9)NO(3) is characterized by specific molecular arrangements and intermolecular interactions.
• The observed hydrogen bonding pattern influences the overall crystal packing.
• This structural information contributes to the understanding of organic solid-state chemistry.