1H,5H-[1,2,4]Triazolo[1,2-A][1,2,4]Triazole-1,3,5,7(2H,6H)-Tetrone

Molecule SVG Image

Properties Simple | Detailed

Formula C4H2N4O4
IUPAC Name [1,2,4]triazolo[1,2-a][1,2,4]triazole-1,3,5,7-tetrone
Molecular Mass 170.083 g·mol−1
Heat of Formation -459.2 ± 16.7 kJ·mol−1
Dipole Moment 1.74 ± 1.08 D
Volume 158.23 Å 3
Surface Area 162.18 Å 2
HOMO Energy -10.80 ± 0.55 eV
LUMO Energy 1.64 ± eV
Point Group Symmetry C2v
Synonyms
  • [1,2,4]triazolo[1,2-a][1,2,4]triazole-1,3,5,7-diquinone
InChIKey VFILOSCIYPWDKE-UHFFFAOYSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O N