5-Methoxy-1,3,4-Thiadiazol-2(3H)-One

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Properties Simple | Detailed

Formula C3H4N2O2S
IUPAC Name 5-methoxy-3h-1,3,4-thiadiazol-2-one
Molecular Mass 132.141 g·mol−1
Heat of Formation -153.2 ± 16.7 kJ·mol−1
Dipole Moment 3.36 ± 1.08 D
Volume 136.38 Å 3
Surface Area 146.69 Å 2
HOMO Energy -9.44 ± 0.55 eV
LUMO Energy 1.55 ± eV
Point Group Symmetry Cs
Synonyms
  • 1,3,4-thiadiazol-2(3h)-one, 5-methoxy-
  • 2-methoxy-5-oxo-delta(2)-1,3,4-thiadiazoline
  • gs 12956
  • gs-12956
CAS Number(s)
  • 17605-27-5
InChIKey LRENRSMVTOWJKZ-UHFFFAOYSA-N
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