2-Amino-9-Phenyl-1,9-Dihydro-6H-Purin-6-One

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Properties Simple | Detailed

Formula C11H16N5O+
IUPAC Name 2-amino-9-phenyl-3,8-dihydropurine-1,2,4,5,7,8-hexaid-6-one
Molecular Mass 234.278 g·mol−1
Heat of Formation 252.1 ± 16.7 kJ·mol−1
Dipole Moment 11.62 ± 1.08 D
Volume 251.65 Å 3
Surface Area 240.41 Å 2
HOMO Energy -9.20 ± 0.55 eV
LUMO Energy -1.00 ± eV
Point Group Symmetry C1
Synonyms
  • 2-amino-9-phenyl-3h-purin-6-one
  • 6h-purin-6-one, 2-amino-1,9-dihydro-9-phenyl-
  • 9-phenylguanine
CAS Number(s)
  • 14443-33-5
InChIKey XOVSLVYAFGLDMS-UHFFFAOYSA-N
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