Geometry & MOs

Info

ID:	291411
PubChem CID:	112378979
Reduced:	NO2C15H21 (1)
Stoich.:	AB2C15D21 (1)
Weight, g/mol:	329.14495
ΔH_f, kcal/mol:	-76.1
Dipole, Da:	3.83
IP(EA), eV:	-9.3(0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-hydroxy-4-phenylbutan-2-yl)-2-phenylsulfanylpropanamide

Drug info:

PubChemData

Smile

CC(C(CC1=CC=CC=C1)O)NC(=O)CCC=C

DOS

IR

Vibrations