1,3-Diethyl-8-Phenyl-3,7-Dihydro-1H-Purine-2,6-Dione

Molecule SVG Image

Properties Simple | Detailed

Formula C15H16N4O2
IUPAC Name 1,3-diethyl-8-phenyl-7h-purine-2,6-dione
Molecular Mass 284.313 g·mol−1
Heat of Formation -141.9 ± 16.7 kJ·mol−1
Dipole Moment 4.11 ± 1.08 D
Volume 333.95 Å 3
Surface Area 302.96 Å 2
HOMO Energy -8.93 ± 0.55 eV
LUMO Energy 2.05 ± eV
Point Group Symmetry C1
Synonyms
  • 1,3-diethyl-8-phenyl-7h-purine-2,6-dione
  • 1,3-diethyl-8-phenyl-7h-purine-2,6-quinone
  • 1,3-diethyl-8-phenylxanthine
  • 1h-purine-2,6-dione, 1,3-diethyl-3,7-dihydro-8-phenyl-
  • depx
  • pdsp1_000323
  • pdsp1_000326
  • pdsp1_000991
  • pdsp2_000321
  • pdsp2_000324
  • pdsp2_000975
CAS Number(s)
  • 75922-48-4
InChIKey LVSWNSHUTPWCNF-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