4-Methylpyrimidine-2(1H)-Thione

Molecule SVG Image

Properties Simple | Detailed

Formula C5H6N2S
IUPAC Name 6-methyl-1h-pyrimidine-2-thione
Molecular Mass 126.180 g·mol−1
Heat of Formation 164.0 ± 16.7 kJ·mol−1
Dipole Moment 7.87 ± 1.08 D
Volume 148.38 Å 3
Surface Area 156.23 Å 2
HOMO Energy -8.53 ± 0.55 eV
LUMO Energy -1.47 ± eV
Point Group Symmetry Cs
Synonyms
  • 2(1h)-pyrimidinethione, 4-methyl-
  • 2-mercapto-4-methylpyrimidine
  • 4-methyl-2(1h)-pyrimidinethione
  • 4-methyl-2-pyrimidinethiol
CAS Number(s)
  • 35071-17-1
InChIKey BVPHXTUEZOQIBS-UHFFFAOYSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H S C N