Geometry & MOs

Info

ID:	195762
PubChem CID:	78732354
Reduced:	FN2O6H17C19 (1)
Stoich.:	AB2C6D17E19 (1)
Weight, g/mol:	343.189592
ΔH_f, kcal/mol:	-214.54
Dipole, Da:	3.27
IP(EA), eV:	-9.1(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-acetyl-N-[[4-(2-oxopyrrolidin-1-yl)phenyl]methyl]piperidine-3-carboxamide

Drug info:

PubChemData

Smile

C1C(OC2=CC=CC=C2O1)C(=O)NNC(=O)COC(=O)CC3=CC(=CC=C3)F

DOS

IR

Vibrations