A novel polycyclic caged compound, tetranitrodiazidoacetylhexaazaisowurtzitane (TNDAIW), has been synthesized by a six-step reaction. The molecular structures of two key intermediates and TNDAIW were identified. The crystal structure of the titled compound was established by X-ray crystallography. Semi-empirical MO calculations were performed with AM1 and PM3 methods based on the crystal structure. The corresponding data of beta-CL-20 are also given for comparison. (Abstract Copyright [2004], Wiley Periodicals, Inc.)
Synthesis, crystal structure and theoretical study of tetranitrodiazidoacetylhexaazaisowurtzitane (TNDAIW)
Propellants, Explosives, Pyrotechnics ; 29 , 3 ; 155-159
2004
5 Seiten, 14 Quellen
Article (Journal)
English
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