2-Amino-7-Phenyl-3,7-Dihydro-6H-Purin-6-One

Molecule SVG Image

Properties Simple | Detailed

Formula C11H9N5O
IUPAC Name 2-amino-7-phenyl-3h-purin-6-one
Molecular Mass 227.222 g·mol−1
Heat of Formation 231.3 ± 16.7 kJ·mol−1
Dipole Moment 2.91 ± 1.08 D
Volume 255.41 Å 3
Surface Area 237.79 Å 2
HOMO Energy -9.08 ± 0.55 eV
LUMO Energy 2.58 ± eV
Point Group Symmetry C1
Synonyms
  • 2-amino-7-phenyl-3h-purin-6-one
  • 6h-purin-6-one, 2-amino-1,7-dihydro-7-phenyl-
  • 7-phenylguanine
  • n(7)-phenylguanine
CAS Number(s)
  • 110718-94-0
InChIKey IGBMZHXVCJHQOL-UHFFFAOYSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O N