Geometry & MOs

Info

ID:	291426
PubChem CID:	112378994
Reduced:	N2O3C18H20 (1)
Stoich.:	A2B3C18D20 (1)
Weight, g/mol:	318.194343
ΔH_f, kcal/mol:	-94.88
Dipole, Da:	2.27
IP(EA), eV:	-9.43(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-hydroxy-4-phenylbutan-2-yl)-5-oxo-1-propan-2-ylpyrrolidine-3-carboxamide

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations