Theoretical study for high-energy-density compounds from cyclophosphazene III. A quantum chemistry study: High nitrogen-contented energetic compound of 1,1,3,3,5,5,7,7-octaazido-cyclo-tetraphosphazene: N4P4(N3)8

Molecular structure, vibrational frequencies and infrared intensities of 1,1,3,3,5,5,7,7-octaazido-cyclo-tetraphosphazene have been studied employing quantum chemistry methods. The NBO population analysis and the heats of formation for the compound was accomplished with the same methods.