3-(3-Fluoro­phenyl­sulfin­yl)-2,4,6,7-tetra­methyl-1-benzofuran
2011

Crystal Structure of a Benzofuran Compound

publication Evidence: moderate

Author Information

Author(s): Choi Hong Dae, Seo Pil Ja, Son Byeng Wha, Lee Uk

Primary Institution: Dongeui University

Conclusion

The crystal structure of the compound shows a dihedral angle of 78.30° between the 3-fluorophenyl ring and the benzofuran fragment, stabilized by weak intermolecular interactions.

Supporting Evidence

  • The benzofuran unit is essentially planar with a mean deviation of 0.016 Å.
  • Weak intermolecular C—H···O hydrogen bonds and C—H···π interactions stabilize the crystal structure.

Takeaway

Scientists studied a special chemical compound and found out how its parts are arranged in a crystal. This helps us understand how it might work in nature.

Methodology

The compound was synthesized and its crystal structure was analyzed using X-ray diffraction.

Digital Object Identifier (DOI)

10.1107/S1600536811016102

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