Geometry & MOs

Info

ID:	74729
PubChem CID:	48422369
Reduced:	FNO3C17H22 (1)
Stoich.:	ABC3D17E22 (1)
Weight, g/mol:	321.168856
ΔH_f, kcal/mol:	-140.78
Dipole, Da:	1.47
IP(EA), eV:	-9.33(-0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl N-[1-(3-acetamidopropylamino)-1-oxo-3-phenylpropan-2-yl]carbamate

Drug info:

PubChemData

Smile

CC(C(=O)N1CCOC(C1)C2=CC=C(C=C2)F)OCC3CC3

DOS

IR

Vibrations