Geometry & MOs

Info

ID:	267732
PubChem CID:	103586614
Reduced:	SF2N2C10H10 (1)
Stoich.:	AB2C2D10E10 (1)
Weight, g/mol:	254.068926
ΔH_f, kcal/mol:	-56.32
Dipole, Da:	1.16
IP(EA), eV:	-8.8(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(2,5-difluoro-4-methylphenyl)-4-ethyl-1H-imidazole-2-thione

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1F)NC2=NCCS2)F

DOS

IR

Vibrations