Geometry & MOs

Info

ID:	341045
PubChem CID:	127263480
Reduced:	ON2H14C15 (1)
Stoich.:	AB2C14D15 (1)
Weight, g/mol:	236.096106
ΔH_f, kcal/mol:	32.68
Dipole, Da:	8.16
IP(EA), eV:	-8.71(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(4-fluorophenyl)methyl]-2-oxopyrrolidine-3-carboxamide

Drug info:

PubChemData

Smile

C1CC2(CC(=O)C=C2)N(C1)C3=CC=C(C=C3)C#N

DOS

IR

Vibrations