Geometry & MOs

Info

ID:	267969
PubChem CID:	103592217
Reduced:	FSN3C15H20 (1)
Stoich.:	ABC3D15E20 (1)
Weight, g/mol:	306.156598
ΔH_f, kcal/mol:	-27.09
Dipole, Da:	5.5
IP(EA), eV:	-8.25(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(4-ethylcyclohexyl)methyl]-6-fluoro-5-methyl-1H-benzimidazole-2-thione

Drug info:

PubChemData

Smile

CC1=CC2=C(C=C1F)NC(=S)N2CC3CCCCN3C

DOS

IR

Vibrations