Geometry & MOs

Info

ID:	362988
PubChem CID:	127310009
Reduced:	F3N3O3C16H22 (1)
Stoich.:	A3B3C3D16E22 (1)
Weight, g/mol:	321.130026
ΔH_f, kcal/mol:	-308.3
Dipole, Da:	5.3
IP(EA), eV:	-9.46(-0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-1-acetyl-N-[2-oxo-1-(2,2,2-trifluoroethyl)pyrrolidin-3-yl]pyrrolidine-2-carboxamide

Drug info:

PubChemData

Smile

C1CCC(C1)N2CC(CC2=O)C(=O)NC3CCN(C3=O)CC(F)(F)F

DOS

IR

Vibrations