1-(4-Hydroxybenzyl)-1,3-Dihydro-2H-Imidazole-2-Thione

Molecule SVG Image

Properties Simple | Detailed

Formula C10H10N2OS
IUPAC Name 1-[(4-hydroxyphenyl)methyl]imidazole-1,3-diium-2-thione
Molecular Mass 206.264 g·mol−1
Heat of Formation 55.1 ± 16.7 kJ·mol−1
Dipole Moment 4.43 ± 1.08 D
Volume 241.64 Å 3
Surface Area 225.64 Å 2
HOMO Energy -8.04 ± 0.55 eV
LUMO Energy -0.24 ± eV
Point Group Symmetry C1
Synonyms
  • 1-(4-hydroxybenzyl)-3h-imidazole-2-thione
  • 1-(4-hydroxybenzyl)imidazole-2-thiol
  • 1-[(4-hydroxyphenyl)methyl]-3h-imidazole-2-thione
  • 1-hbit
CAS Number(s)
  • 95333-64-5
InChIKey WVWZHFJGVDNBDA-UHFFFAOYSA-N
QR Code Generate QR Code
Links PubChem ChemSpider
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H S C O N