Geometry & MOs

Info

ID:

291402

PubChem CID:

112378970

Reduced:

NO2C18H21 (1)

Stoich.:

AB2C18D21 (1)

Weight, g/mol:

263.188529

ΔHf, kcal/mol:

-64.05

Dipole, Da:

4.05

IP(EA), eV:

-9.23(-0.5)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)C(=O)NC(C)C(CC2=CC=CC=C2)O

DOS

IR

Vibrations