Suritozole

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Properties Simple | Detailed

Formula C10H10FN3S
IUPAC Name 5-(3-fluorophenyl)-2,4-dimethyl-1,2,4-triazole-2,4-diium-3-thione
Molecular Mass 223.270 g·mol−1
Heat of Formation 127.1 ± 16.7 kJ·mol−1
Dipole Moment 4.53 ± 1.08 D
Volume 256.07 Å 3
Surface Area 241.5 Å 2
HOMO Energy -8.20 ± 0.55 eV
LUMO Energy -0.98 ± eV
Point Group Symmetry C1
Synonyms
  • 2,4-dihydro-2,4-dimethyl-5-(3-fluorophenyl)-3h-1,2,4-triazole-3-thione
  • 3-(m-fluorophenyl)-1,4-dimethyl-delta(sup 2)-1,2,4-triazoline-5-thione
  • 3h-1,2,4-triazole-3-thione, 2,4-dihydro-2,4-dimethyl-5-(3-fluorophenyl)-
  • 3h-1,2,4-triazole-3-thione, 5-(3-fluorophenyl)-2,4-dihydro-2,4-dimethyl-
  • 5-(3-fluorophenyl)-2,4-dihydro-2,4-dimethyl-3h-1,2,4-triazole-3-thione
  • 5-(3-fluorophenyl)-2,4-dimethyl-1,2,4-triazole-3-thione
  • d05980
  • mdl 26,479
  • mdl-26479
  • suritozole (usan)
CAS Number(s)
  • 110623-33-1
InChIKey IWDUZEHNLHFBRZ-UHFFFAOYSA-N
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