1-Benzyl-5-(Hydroxymethyl)-1,3-Dihydro-2H-Imidazole-2-Thione

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Properties Simple | Detailed

Formula C11H12N2OS
IUPAC Name 1-benzyl-5-(hydroxymethyl)imidazole-1,3-diium-2-thione
Molecular Mass 220.291 g·mol−1
Heat of Formation 50.5 ± 16.7 kJ·mol−1
Dipole Moment 4.61 ± 1.08 D
Volume 262.94 Å 3
Surface Area 237.62 Å 2
HOMO Energy -8.07 ± 0.55 eV
LUMO Energy -0.37 ± eV
Point Group Symmetry C1
Synonyms
  • 1-(benzyl)-5-methylol-3h-imidazole-2-thione
  • 5-(hydroxymethyl)-1-(phenylmethyl)-3h-imidazole-2-thione
InChIKey IIQWCVZBUKMFBS-UHFFFAOYSA-N
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