Geometry & MOs

Info

ID:	252540
PubChem CID:	103112121
Reduced:	OSN3C13H17 (1)
Stoich.:	ABC3D13E17 (1)
Weight, g/mol:	406.99646
ΔH_f, kcal/mol:	-8.59
Dipole, Da:	6.86
IP(EA), eV:	-8.44(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-ethyl-2-(6-fluoro-5-iodo-2-sulfanylidene-3H-benzimidazol-1-yl)-N-methylpropanamide

Drug info:

PubChemData

Smile

CCN(C)C(=O)C(C)N1C2=CC=CC=C2NC1=S

DOS

IR

Vibrations