2,4,6-Trinitro-N-(2,4,6-Trinitrophenyl)Aniline

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Formula C12H5N7O12
IUPAC Name 2,4,6-trinitro-n-(2,4,6-trinitrophenyl)aniline
Molecular Mass 439.208 g·mol−1
Heat of Formation 184.9 ± 16.7 kJ·mol−1
Dipole Moment 0.96 ± 1.08 D
Volume 401.4 Å 3
Surface Area 342.34 Å 2
HOMO Energy -10.87 ± 0.55 eV
LUMO Energy -3.08 ± eV
Point Group Symmetry C1
InChIKey SCYPWRULZZWQQW-UHFFFAOYSA-N
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