Geometry & MOs

Info

ID:	17639
PubChem CID:	509424
Reduced:	IOS2N4C13H15 (1)
Stoich.:	ABC2D4E13F15 (1)
Weight, g/mol:	433.9732
ΔH_f, kcal/mol:	43.44
Dipole, Da:	2.29
IP(EA), eV:	-8.36(-1.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[5-(2-ethylsulfanylethylamino)-1,3,4-thiadiazol-2-yl]-4-iodobenzamide

Drug info:

PubChemData

Smile

CCSCCNC1=NN=C(S1)NC(=O)C2=CC=C(C=C2)I

DOS

IR

Vibrations