Geometry & MOs

Info

ID:	173094
PubChem CID:	75595325
Reduced:	NO3C17H23 (1)
Stoich.:	AB3C17D23 (1)
Weight, g/mol:	469.236542
ΔH_f, kcal/mol:	-109.13
Dipole, Da:	1.39
IP(EA), eV:	-8.67(0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[1-(naphthalene-1-carbonyl)pyrrolidine-2-carbonyl]-N-(1-phenylethyl)pyrrolidine-2-carboxamide

Drug info:

PubChemData

Smile

C1CCC2(CCN(CC2C1)CC3=C4C(=CC=C3)OCO4)O

DOS

IR

Vibrations