4,5-Diaminopyrimidine-2-Thiol

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Properties Simple | Detailed

Formula C4H6N4S+
IUPAC Name 5,6-diaminopyrimidine-2-thione
Molecular Mass 142.182 g·mol−1
Heat of Formation 214.0 ± 16.7 kJ·mol−1
Dipole Moment 8.39 ± 1.08 D
Volume 155.9 Å 3
Surface Area 163.69 Å 2
HOMO Energy -8.34 ± 0.55 eV
LUMO Energy -1.33 ± eV
Point Group Symmetry Cs
Synonyms
  • 2(1h)-pyrimidinethione, 4,5-diamino-
  • 2-pyrimidinethiol, 4,5-diamino-
  • 4,5-diamino-3h-pyrimidine-2-thione
InChIKey KDVXWCSUTDEXFF-UHFFFAOYSA-N
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Elements H S C N