6-Methylpurine

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Properties Simple | Detailed

Formula C6H6N4
IUPAC Name 6-methyl-7h-purine-1,3,9-triium-5-ide
Molecular Mass 134.139 g·mol−1
Heat of Formation 279.4 ± 16.7 kJ·mol−1
Dipole Moment 6.86 ± 1.08 D
Volume 154.84 Å 3
Surface Area 158.79 Å 2
HOMO Energy -9.89 ± 0.55 eV
LUMO Energy -1.23 ± eV
Point Group Symmetry Cs
Synonyms
  • 1h-purine, 6-methyl-
  • 1h-purine, 6-methyl- (9ci)
  • 6-methyl purine
  • 6-methyl-1h-purine
  • 6-methyl-7h-purine
  • 6mp
  • purine, 6-methyl-
CAS Number(s)
  • 2004-03-7
InChIKey SYMHUEFSSMBHJA-UHFFFAOYSA-N
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Elements H C N