6-(Trifluoromethyl)-1,4-Dihydro-2,3-Quinoxalinedione

Molecule SVG Image

Properties Simple | Detailed

Formula C9H5F3N2O2
IUPAC Name 6-(trifluoromethyl)-1,4-dihydroquinoxaline-2,3-dione
Molecular Mass 230.143 g·mol−1
Heat of Formation -858.5 ± 16.7 kJ·mol−1
Dipole Moment 2.84 ± 1.08 D
Volume 225.66 Å 3
Surface Area 214.98 Å 2
HOMO Energy -9.49 ± 0.55 eV
LUMO Energy -1.46 ± eV
Point Group Symmetry Cs
Synonyms
  • 1,4-dihydro-6-trifluoromethylquinoxaline-2,3-dione
  • 6-(trifluoromethyl)-1,4-dihydroquinoxaline-2,3-quinone
  • lilly-72525
CAS Number(s)
  • 55687-31-5
InChIKey BQNVOJRAHONGMT-UHFFFAOYSA-N
QR Code Generate QR Code
Links PubChem ChemSpider
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C N O F