Geometry & MOs

Info

ID:	227825
PubChem CID:	87562595
Reduced:	N2O3F6H14C15 (1)
Stoich.:	A2B3C6D14E15 (1)
Weight, g/mol:	199.132077
ΔH_f, kcal/mol:	-413.32
Dipole, Da:	5.05
IP(EA), eV:	-10.39(-1.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[2-oxoethyl(pyrrolidin-1-yl)amino]propanamide

Drug info:

PubChemData

Smile

C[C@H]1[C@H](C[C@H](C(=O)N1CC(F)(F)F)NC(=O)O)C2=C(C=CC(=C2F)F)F

DOS

IR

Vibrations