Geometry & MOs

Info

ID:	153167
PubChem CID:	56312316
Reduced:	N2O2C25H32 (1)
Stoich.:	A2B2C25D32 (1)
Weight, g/mol:	389.210327
ΔH_f, kcal/mol:	-55.3
Dipole, Da:	5.83
IP(EA), eV:	-8.69(0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[3-[4-[(4-methoxyphenyl)methyl]piperidin-1-yl]-2-oxopyrrolidin-1-yl]benzonitrile

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)CC2CCN(CC2)CC3=CC=C(C=C3)C(=O)N4CCCC4

DOS

IR

Vibrations