5,5-Dimethyl-2-[6-methyl-2-(methylsulfanyl)pyrimidin-4-yloxy]-1,3,2-dioxaphosphorinane-2-thione

Acta Crystallogr C. 2002 May;58(Pt 5):o280-1. doi: 10.1107/s0108270102005218. Epub 2002 Apr 19.

Abstract

The title compound, C(11)H(17)N(2)O(3)PS(2), is a cyclic thiophosphoryl pyrimidine derivative exhibiting insecticidal properties. The crystal structure determination gives evidence for the presence of the thione isomer of the compound. The pyrimidine nucleus is planar and its substituents have small deviations from the least-squares plane. The dioxaphosphorinane ring adopts a chair conformation. The lack of classical hydrogen bonds and the weak intermolecular interactions lead to a 'loose' packing characterized by channels in the structure.

MeSH terms

  • Crystallography, X-Ray
  • Indicators and Reagents
  • Models, Molecular
  • Molecular Conformation
  • Organophosphorus Compounds / chemical synthesis
  • Organophosphorus Compounds / chemistry*
  • Organothiophosphorus Compounds / chemical synthesis
  • Organothiophosphorus Compounds / chemistry*
  • Pyrimidines / chemical synthesis
  • Pyrimidines / chemistry*

Substances

  • 5,5-dimethyl-2-(6-methyl-2-(methylsulfanyl)pyrimidin-4-yloxy)-1,3,2-dioxaphosphorinane-2-thione
  • Indicators and Reagents
  • Organophosphorus Compounds
  • Organothiophosphorus Compounds
  • Pyrimidines