(S)-[5-Methyl-3-(3-methyl­thio­phen-2-yl)-4,5-dihydro­isoxazol-5-yl]methanol
2011

Crystal Structure of a New Isoxazoline Herbicide

publication Evidence: moderate

Author Information

Author(s): Ko Young Kwan, Ryu Jae Wook, Koo Dong Wan, Woo Jae Choon, Kim Chong-Hyeak

Primary Institution: Korea Research Institute of Chemical Technology

Conclusion

The crystal structure of the compound shows that the thiophene and isoxazoline rings are nearly coplanar, allowing for the formation of hydrogen bonds that create a one-dimensional chain.

Supporting Evidence

  • The compound's structure allows for hydrogen bonding.
  • The dihedral angle between the thiophene and isoxazoline rings is only 2.08 degrees.
  • Single crystals suitable for X-ray diffraction were obtained.

Takeaway

Scientists studied a new herbicide and found that its structure allows it to stick together in a chain, which might help it work better.

Methodology

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

Digital Object Identifier (DOI)

10.1107/S1600536811011639

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