Geometry & MOs

Info

ID:	124166
PubChem CID:	50873692
Reduced:	NO2Cl3H8C11 (1)
Stoich.:	AB2C3D8E11 (1)
Weight, g/mol:	301.027249
ΔH_f, kcal/mol:	-81.59
Dipole, Da:	4.67
IP(EA), eV:	-9.15(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 1-(3,4-dichlorophenyl)-5-oxopyrrolidine-3-carboxylate

Drug info:

PubChemData

Smile

C1C(CN(C1=O)C2=CC(=C(C=C2)Cl)Cl)C(=O)Cl

DOS

IR

Vibrations