(2Z)-3-(Carbamimidoylsulfanyl)Acrylic Acid

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Properties Simple | Detailed

Formula C4H6N2O2S
IUPAC Name (z)-3-carbamimidoylsulfanylprop-2-enoic acid
Molecular Mass 146.168 g·mol−1
Heat of Formation -232.3 ± 16.7 kJ·mol−1
Dipole Moment 3.05 ± 1.08 D
Volume 160.78 Å 3
Surface Area 169.01 Å 2
HOMO Energy -9.13 ± 0.55 eV
LUMO Energy -0.69 ± eV
Point Group Symmetry C1
Synonyms
  • (z)-3-(amidinothio)acrylic acid
  • (z)-3-(carbamimidoylthio)prop-2-enoic acid
  • (z)-3-carbamimidoylsulfanylprop-2-enoic acid
  • biomol-nt_000258
  • bpbio1_000727
  • tocris-0180
InChIKey QEYNZJBVNYDZKZ-UPHRSURJSA-N
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