6-Amino-1-Methyl-7H-Purin-1-Ium

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Properties Simple | Detailed

Formula C6H8N5
IUPAC Name 1-methylpurine-3,7,9-triium-6-id-6-amine
Molecular Mass 150.161 g·mol−1
Heat of Formation 365.7 ± 16.7 kJ·mol−1
Dipole Moment 10.92 ± 1.08 D
Volume 170.57 Å 3
Surface Area 171.14 Å 2
HOMO Energy -8.92 ± 0.55 eV
LUMO Energy -1.09 ± eV
Point Group Symmetry Cs
Synonyms
  • (1-methyl-7h-purin-1-ium-6-yl)amine
  • 1-methyl-6,9-dihydro-1h-purin-6-ylamine
  • 1-methyl-7h-purin-1-ium-6-amine
  • 6-amino-1-methylpurine
  • m1a
InChIKey DYGBIJOMQSXREB-UHFFFAOYSA-O
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Elements H C N