Experimental and Theoretical Electron Paramagnetic Resonance (EPR) Study on the Temperature-Dependent Structural Changes of Methylsulfanylmethane


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Tapramaz R., Turkkan E., DERELİ Ö.

INTERNATIONAL JOURNAL OF MOLECULAR SCIENCES, cilt.12, sa.8, ss.4909-4922, 2011 (SCI-Expanded, Scopus) identifier identifier identifier

  • Yayın Türü: Makale / Tam Makale
  • Cilt numarası: 12 Sayı: 8
  • Basım Tarihi: 2011
  • Doi Numarası: 10.3390/ijms12084909
  • Dergi Adı: INTERNATIONAL JOURNAL OF MOLECULAR SCIENCES
  • Derginin Tarandığı İndeksler: Science Citation Index Expanded (SCI-EXPANDED), Scopus
  • Sayfa Sayıları: ss.4909-4922
  • Anahtar Kelimeler: EPR, methylsulfanylmethane, radiation damage, radical, DIMETHYL SULFONE, SPIN-RESONANCE, HYPERFINE SPLITTINGS, RADICALS, PHARMACOLOGY, SULFOXIDE
  • Açık Arşiv Koleksiyonu: AVESİS Açık Erişim Koleksiyonu
  • Ondokuz Mayıs Üniversitesi Adresli: Evet

Özet

Methylsulfonylmethane (or dimethyl sulfone), a naturally produced and vitally important organosulfur compound in living organisms, was irradiated with gamma rays, and the produced radicals were investigated using electron paramagnetic resonance spectroscopy at different temperatures. The structure and behavior of the radical changed when the temperatures varied. The hyperfine splitting of the CH3 group was small, and the S-33 splitting was relatively high between 80 and -50 degrees C. When the temperature was between -50 and -160 degrees C, the S-33 splitting became small and the CH3 splitting was higher. However, the group kept rotating; therefore, only the isotropic splitting values were measured, and the g-values were anisotropic. When the temperature decreased below -180 degrees C, the CH3 group stopped rotating, and the hydrogen splitting values became nonequivalent due to an inhomogeneous electron distribution. The observed structures can be explained by referring to both the experimental and theoretically calculated values reported.