N-Methyl-N-Nitroso-1H-Purin-6-Amine

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Properties Simple | Detailed

Formula C6H6N6O
IUPAC Name n-methyl-n-(7h-purin-6-yl)nitrous amide
Molecular Mass 178.151 g·mol−1
Heat of Formation 358.6 ± 16.7 kJ·mol−1
Dipole Moment 4.58 ± 1.08 D
Volume 190.59 Å 3
Surface Area 188.63 Å 2
HOMO Energy -9.61 ± 0.55 eV
LUMO Energy -1.45 ± eV
Point Group Symmetry C1
Synonyms
  • (n-6)-(methylnitroso)adenine
  • 1h-purin-6-amine, n(sup 6)-methyl-n(sup 6)-nitroso-
  • 1h-purin-6-amine, n-methyl-n-nitroso-
  • 6-(methylnitrosamino)purine
  • 6-mna
  • adenine, n-methyl-n-nitroso-
  • n(6)-(methylnitroso)adenosine
  • n-methyl-n-(7h-purin-6-yl)nitrous amide
  • n-methyl-n-nitroso-9h-purin-6-amine
  • n-methyl-n-nitrosoadenine
CAS Number(s)
  • 21928-82-5
InChIKey HTWGDSKVENTDTB-UHFFFAOYSA-N
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