Geometry & MOs

Info

ID:	207375
PubChem CID:	80388835
Reduced:	OF2N2H14C15 (1)
Stoich.:	AB2C2D14E15 (1)
Weight, g/mol:	269.08635
ΔH_f, kcal/mol:	-100.41
Dipole, Da:	2.64
IP(EA), eV:	-8.64(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(2,4-difluorophenyl)acetyl]pyrrolidine-2-carboxylic acid

Drug info:

PubChemData

Smile

C1=CC(=CC(=C1)N)CNC(=O)CC2=C(C=C(C=C2)F)F

DOS

IR

Vibrations