Geometry & MOs

Info

ID:	291446
PubChem CID:	112379014
Reduced:	NOC9H12 (2)
Stoich.:	ABC9D12 (2)
Weight, g/mol:	332.209993
ΔH_f, kcal/mol:	-71.55
Dipole, Da:	3.65
IP(EA), eV:	-9.28(0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-butanoyl-N-(3-hydroxy-4-phenylbutan-2-yl)pyrrolidine-2-carboxamide

Drug info:

PubChemData

Smile

CC(C(CC1=CC=CC=C1)O)NC(=O)C2(CCCCC2)C#N

DOS

IR

Vibrations