2H-1,3-Oxazine-2,6(3H)-Dione

Molecule SVG Image

Properties Simple | Detailed

Formula C4H4NO3++
IUPAC Name 3h-1,3-oxazine-2,6-dione
Molecular Mass 114.079 g·mol−1
Heat of Formation -429.3 ± 16.7 kJ·mol−1
Dipole Moment 6.39 ± 1.08 D
Volume 115.73 Å 3
Surface Area 128.29 Å 2
HOMO Energy -10.41 ± 0.55 eV
LUMO Energy -1.03 ± eV
Point Group Symmetry Cs
Synonyms
  • 2,3-dihydro-1,3-6h-oxazine-2,6-dione
  • 3-oxauracil
  • 3h-1,3-oxazine-2,6-quinone
CAS Number(s)
  • 34314-63-1
InChIKey WQAIPNTUCFSZRZ-UHFFFAOYSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O N