4,6-Dinitrobenzofuroxane

Molecule SVG Image

Properties Simple | Detailed

Formula C6H2N4O6
IUPAC Name 4,6-dinitro-1-oxido-2,1,3-benzoxadiazol-1-ium
Molecular Mass 226.103 g·mol−1
Heat of Formation 308.7 ± 16.7 kJ·mol−1
Dipole Moment 4.24 ± 1.08 D
Volume 209.08 Å 3
Surface Area 204.12 Å 2
HOMO Energy -10.42 ± 0.55 eV
LUMO Energy -3.33 ± eV
Point Group Symmetry Cs
Synonyms
  • 2,1,3-benzoxadiazole, 4,6-dinitro-, 1-oxide
  • 4,6-dinitro-1-oxido-benzofurazan-1-ium
  • benzofurazan, 4,6-dinitro-, 1-oxide
CAS Number(s)
  • 68777-72-0
  • 3439-98-3
  • 5128-28-9
InChIKey YHBBUAULQKLKMW-UHFFFAOYSA-N
QR Code Generate QR Code
Links PubChem ChemSpider
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O N