5-{[(3-Fluorophenyl)Amino]Methylene}-2,2-Dimethyl-1,3-Dioxane-4,6-Dione

Molecule SVG Image

Properties Simple | Detailed

Formula C13H12FNO4
IUPAC Name 5-[(3-fluoroanilino)methylene]-2,2-dimethyl-1,3-dioxane-4,6-dione
Molecular Mass 265.237 g·mol−1
Heat of Formation -798.6 ± 16.7 kJ·mol−1
Dipole Moment 3.09 ± 1.08 D
Volume 290.75 Å 3
Surface Area 275.31 Å 2
HOMO Energy -9.58 ± 0.55 eV
LUMO Energy 1.59 ± eV
Point Group Symmetry C1
Synonyms
  • 5-[[(3-fluorophenyl)amino]methylene]-2,2-dimethyl-1,3-dioxane-4,6-dione
  • 5-[[(3-fluorophenyl)amino]methylene]-2,2-dimethyl-1,3-dioxane-4,6-quinone
  • stock2s-61386
InChIKey OSEZEAKECQZFAJ-UHFFFAOYSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C N O F