3,5-Dinitro-N,N'-Bis(2,4,6-Trinitrophenyl)-2,6-Pyridinediamine

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Formula C17H7N11O16
IUPAC Name 3,5-dinitro-n2,n6-bis(2,4,6-trinitrophenyl)pyridine-2,6-diamine
Molecular Mass 621.302 g·mol−1
Heat of Formation 277.7 ± 16.7 kJ·mol−1
Dipole Moment 0.94 ± 1.08 D
Volume 573.76 Å 3
Surface Area 421.53 Å 2
HOMO Energy -10.82 ± 0.55 eV
LUMO Energy -0.28 ± eV
Point Group Symmetry C2
Synonyms
  • 2,6-bis(picrylamino)-3,5-dinitropyridine
  • 2,6-pyridinediamine, 3,5-dinitro-n,n'-bis(2,4,6-trinitrophenyl)-
  • pyx
  • pyx explosive
CAS Number(s)
  • 38082-89-2
  • 57158-12-0
InChIKey YSSXHRVRZWIAKV-UHFFFAOYSA-N
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