Geometry & MOs

Info

ID:	76579
PubChem CID:	48425112
Reduced:	F3N4O4C15H23 (1)
Stoich.:	A3B4C4D15E23 (1)
Weight, g/mol:	379.208276
ΔH_f, kcal/mol:	-341.04
Dipole, Da:	4.75
IP(EA), eV:	-9.12(-0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-propan-2-yl-4-[4-[3-(2,2,2-trifluoroethoxy)propyl]piperazine-1-carbonyl]pyrrolidin-2-one

Drug info:

PubChemData

Smile

C1CN(CCN1CCCOCC(F)(F)F)C(=O)CCC2C(=O)NC(=O)N2

DOS

IR

Vibrations