Structure-Sensitivity Relationships in Energetic Compounds

作者: J. S. Murray , P. Politzer

DOI: 10.1007/978-94-009-2035-4_8

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摘要: Considerable progress has been made in understanding factors influencing the sensitivities of energetic molecules to outside stimuli such as shock, impact and heat. In this chapter, we discuss correlations between molecular properties impact/shock sensitivity also special cases that do not follow relationships. For nitramines nitroaliphatics, taken separately, have shown strengths all N-NO2 linkages these systems, conjunction with overall size, are important determining their shock sensitivities. nitroaromatics (excluding hydroxy derivatives) found a relationship electrostatic potential at midpoint C-NO2 bond, approximated by atomic charges. We suggest high hydroxynitroaromatics may be due formation small quantities unstable nitronic acid tautomers.

参考文章(45)
Donna Price, T. P. Liddiard, Jr., THE SMALL SCALE GAP TEST: CALIBRATION AND COMPARISON WITH THE LARGE SCALE GAP TEST Defense Technical Information Center. ,(1966) , 10.21236/AD0487353
Joel F. Liebman, Arthur Greenberg, Structure and reactivity VCH Publishers. ,(1988)
Marvin Charton, Electrical Effect Substituent Constants for Correlation Analysis Progress in Physical Organic Chemistry, Volume 13. pp. 119- 251 ,(2007) , 10.1002/9780470171929.CH3
A.E. Foti, V.H. Smith, S. Fliszár, Charge distributions and chemical effects Journal of Molecular Structure. ,vol. 68, pp. 227- 234 ,(1980) , 10.1016/0022-2860(80)80274-2
Henry Feuer, The chemistry of the nitro and nitroso groups Interscience Publishers. ,(1969)
Linus Pauling, The Nature of the Chemical Bond ,(1939)
R. S. Mulliken, Electronic Population Analysis on LCAO–MO Molecular Wave Functions. I The Journal of Chemical Physics. ,vol. 23, pp. 1833- 1840 ,(1955) , 10.1063/1.1740588
Alicia C. Gonzalez, C. William Larson, Donald F. McMillen, David M. Golden, Mechanism of decomposition of nitroaromatics. Laser-powered homogeneous pyrolysis of substituted nitrobenzenes The Journal of Physical Chemistry. ,vol. 89, pp. 4809- 4814 ,(1985) , 10.1021/J100268A030
Peter N. Neuman, Nitro derivatives of phenyl-1,2,3-triazole Journal of Heterocyclic Chemistry. ,vol. 8, pp. 51- 56 ,(1971) , 10.1002/JHET.5570080111
F I Dubovitskii, Boris L Korsunskii, Kinetics of the Thermal Decomposition of N-Nitro-compounds Russian Chemical Reviews. ,vol. 50, pp. 958- 978 ,(1981) , 10.1070/RC1981V050N10ABEH002721