S-[(3Z)-3-Amino-3-Iminopropyl] Dihydrogen Phosphorothioate

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Properties Simple | Detailed

Formula C3H9N2O3PS
IUPAC Name (3-amino-3-imino-propyl)sulfanylphosphonic acid
Molecular Mass 184.154 g·mol−1
Heat of Formation -804.5 ± 16.7 kJ·mol−1
Dipole Moment 2.94 ± 1.08 D
Volume 195.94 Å 3
Surface Area 188.33 Å 2
HOMO Energy -9.34 ± 0.55 eV
LUMO Energy -0.95 ± eV
Point Group Symmetry C1
Synonyms
  • (3-amino-3-iminopropyl)sulfanylphosphonic acid
  • [(3-amino-3-imino-propyl)thio]phosphonic acid
  • [(3-amino-3-iminopropyl)thio]phosphonic acid
  • propanimidamide, 3-((dihydroxyphosphinyl)thio)-
  • s,beta-amidinoethyl thiophosphate
  • s-(2-amidinoethyl)thiophosphate
  • s-(beta-amidinoethyl)thiophosphate
  • s-amettp
CAS Number(s)
  • 149206-93-9
InChIKey YTRAEXCLCYQLDM-UHFFFAOYSA-N
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