Geometry & MOs

Info

ID:	151566
PubChem CID:	53837799
Reduced:	NO2H17C19 (1)
Stoich.:	AB2C17D19 (1)
Weight, g/mol:	411.198048
ΔH_f, kcal/mol:	-16.08
Dipole, Da:	2.75
IP(EA), eV:	-8.45(-0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-benzylsulfanyl-4-oxoazetidin-1-yl)-N-(6-pyridin-4-ylhexyl)acetamide

Drug info:

PubChemData

Smile

CCOC(=O)C1=C(C2=CC=CC=C2N1)C=CC3=CC=CC=C3

DOS

IR

Vibrations