Tcmdc-124283

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Properties Simple | Detailed

Formula C5H4FN5
IUPAC Name 2-fluoropurin-7-ium-6-amine
Molecular Mass 153.117 g·mol−1
Heat of Formation 143.3 ± 16.7 kJ·mol−1
Dipole Moment 9.58 ± 1.08 D
Volume 157.02 Å 3
Surface Area 162.08 Å 2
HOMO Energy -9.46 ± 0.55 eV
LUMO Energy 2.03 ± eV
Point Group Symmetry Cs
Synonyms
  • (2-fluoro-7h-purin-6-yl)amine
  • 1h-purin-6-amine, 2-fluoro-
  • 1h-purin-6-amine, 2-fluoro- (9ci)
  • 2-fad
  • 2-fluoro-1h-purin-6-amine
  • 2-fluoro-6-aminopurine
  • 2-fluoro-7(9)h-purin-6-ylamine
  • 2-fluoro-7h-purin-6-amine
  • 2-fluoroadenine
  • 9h-adenine, 2-fluoro-
  • adenine, 2-fluoro-
  • adenine, 2-fluoro- (van) (8ci)
  • purine, 6-amino-2-fluoro-
  • sri 774
CAS Number(s)
  • 700-49-2
InChIKey WKMPTBDYDNUJLF-UHFFFAOYSA-N
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Elements H C N F