Geometry & MOs

Info

ID:	136678
PubChem CID:	52083793
Reduced:	ClSO3N5H20C21 (1)
Stoich.:	ABC3D5E20F21 (1)
Weight, g/mol:	203.134385
ΔH_f, kcal/mol:	18.53
Dipole, Da:	10.37
IP(EA), eV:	-8.87(-1.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-propylsulfanylethyl)pentanamide

Drug info:

PubChemData

Smile

CC(C)C1=CC=C(C=C1)OCC(=O)NC2=NN3C(=NN=C3S2)COC4=CC=C(C=C4)Cl

DOS

IR

Vibrations