Geometry & MOs

Info

ID:	267978
PubChem CID:	103592450
Reduced:	FSN4C14H15 (1)
Stoich.:	ABC4D14E15 (1)
Weight, g/mol:	321.076968
ΔH_f, kcal/mol:	20.26
Dipole, Da:	4.81
IP(EA), eV:	-8.31(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[1-(5-ethyl-1,3-thiazol-2-yl)ethyl]-6-fluoro-5-methyl-1H-benzimidazole-2-thione

Drug info:

PubChemData

Smile

CC1=CC2=C(C=C1F)NC(=S)N2CC3=CN(N=C3C)C

DOS

IR

Vibrations