Geometry & MOs

Info

ID:	371363
PubChem CID:	127345967
Reduced:	O3N4C18H30 (1)
Stoich.:	A3B4C18D30 (1)
Weight, g/mol:	346.189257
ΔH_f, kcal/mol:	-105.56
Dipole, Da:	4.06
IP(EA), eV:	-8.66(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-methoxy-5-methylphenyl)-1-[2-(oxolan-3-yl)acetyl]pyrrolidine-2-carboxamide

Drug info:

PubChemData

Smile

CCC1=C(N=CO1)C(=O)N2CCN(CC2)CC3CN(CCO3)C(C)C

DOS

IR

Vibrations