Geometry & MOs

Info

ID:	154958
PubChem CID:	56314515
Reduced:	OSF2N4H18C21 (1)
Stoich.:	ABC2D4E18F21 (1)
Weight, g/mol:	403.082447
ΔH_f, kcal/mol:	-58.4
Dipole, Da:	2.39
IP(EA), eV:	-8.5(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[5-fluoro-2-(1-methylimidazol-2-yl)sulfanylphenyl]-2-(4-methoxyphenyl)sulfanylacetamide

Drug info:

PubChemData

Smile

CC1=C(C2=C(N1)C=CC(=C2)F)CC(=O)NC3=C(C=CC(=C3)F)SC4=NC=CN4C

DOS

IR

Vibrations