Geometry & MOs

Info

ID:	197598
PubChem CID:	78981658
Reduced:	ClN2O2C13H15 (1)
Stoich.:	AB2C2D13E15 (1)
Weight, g/mol:	340.04226
ΔH_f, kcal/mol:	-74.81
Dipole, Da:	5.83
IP(EA), eV:	-9.7(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(4-bromophenoxy)ethyl]-N-methyl-5-oxopyrrolidine-3-carboxamide

Drug info:

PubChemData

Smile

CN(CC1=CC=C(C=C1)Cl)C(=O)C2CC(=O)NC2

DOS

IR

Vibrations