Geometry & MOs

Info

ID:	267727
PubChem CID:	103586210
Reduced:	F2N2C11H14 (1)
Stoich.:	A2B2C11D14 (1)
Weight, g/mol:	226.091769
ΔH_f, kcal/mol:	-70.51
Dipole, Da:	1.93
IP(EA), eV:	-8.38(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-amino-1-(2,5-difluoro-4-methylphenyl)pyrrolidin-2-one

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1F)N2CCNCC2)F

DOS

IR

Vibrations