3-Methyl[1,2]Thiazolo[4,3-D][1,2]Oxazol-4-Amine

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Properties Simple | Detailed

Formula C5H5N3OS
IUPAC Name 3-methylisothiazolo[4,3-d]isoxazol-4-amine
Molecular Mass 155.178 g·mol−1
Heat of Formation 227.4 ± 16.7 kJ·mol−1
Dipole Moment 8.40 ± 1.08 D
Volume 166.75 Å 3
Surface Area 165.48 Å 2
HOMO Energy -8.95 ± 0.55 eV
LUMO Energy 2.00 ± eV
Point Group Symmetry Cs
Synonyms
  • (3-methylisothiazolo[4,3-d]isoxazol-4-yl)amine
  • 3-methyl-4-isothiazolo[4,3-d]isoxazolamine
  • 3-methyl-[1,2]thiazolo[4,3-d][1,2]oxazol-4-amine
InChIKey KQMIMMANZSNBGL-UHFFFAOYSA-N
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