N-[4-(5-Thioxo-4,5-Dihydro-1,3,4-Oxadiazol-2-Yl)Phenyl]Hydrazinecarbothioamide

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Properties Simple | Detailed

Formula C9H9N5OS2
IUPAC Name 1-amino-3-[4-(2-thioxo-3h-1,3,4-oxadiazol-5-yl)phenyl]thiourea
Molecular Mass 267.331 g·mol−1
Heat of Formation 357.5 ± 16.7 kJ·mol−1
Dipole Moment 7.49 ± 1.08 D
Volume 290.28 Å 3
Surface Area 276.98 Å 2
HOMO Energy -8.73 ± 0.55 eV
LUMO Energy -1.45 ± eV
Point Group Symmetry C1
Synonyms
  • 3-amino-1-[4-(5-thioxo-4h-1,3,4-oxadiazol-2-yl)phenyl]thiourea
  • chemdiv1_000184
InChIKey DSZWZHYEFYRNQI-UHFFFAOYSA-N
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