Structure-Impact Sensitivity Relation of Certain Explosive Compounds

TÜRKER B. L.

JOURNAL OF ENERGETIC MATERIALS, cilt.27, sa.2, ss.94-109, 2009 (SCI-Expanded) identifier identifier

  • Yayın Türü: Makale / Tam Makale
  • Cilt numarası: 27 Sayı: 2
  • Basım Tarihi: 2009
  • Doi Numarası: 10.1080/07370650802405182
  • Dergi Adı: JOURNAL OF ENERGETIC MATERIALS
  • Derginin Tarandığı İndeksler: Science Citation Index Expanded (SCI-EXPANDED), Scopus
  • Sayfa Sayıları: ss.94-109
  • Anahtar Kelimeler: explosives, impact sensitivity, polynitro benzenes, structure-activity relationship, topology
  • Orta Doğu Teknik Üniversitesi Adresli: Evet

Özet

A theoretical model is developed within the Huckel molecular orbital theory for the structure-impact sensitivity relation of some explosive compounds. The model considers some topological properties of a given molecule as well as the number of certain substituents. Also, a regression equation has been obtained for polynitrobenzenes having a high degree of significance. In light of the equations developed, effects of factors on impact sensitivity are discussed.