Geometry & MOs

Info

ID:	55105
PubChem CID:	17389770
Reduced:	ClN2O2F3H10C12 (1)
Stoich.:	AB2C2D3E10F12 (1)
Weight, g/mol:	252.066555
ΔH_f, kcal/mol:	-233.73
Dipole, Da:	4.17
IP(EA), eV:	-9.7(-1.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-chloro-4-methylphenyl)-5-oxopyrrolidine-2-carboxamide

Drug info:

PubChemData

Smile

C1CC(=O)NC1C(=O)NC2=C(C=CC(=C2)C(F)(F)F)Cl

DOS

IR

Vibrations