Geometry & MOs

Info

ID:	76577
PubChem CID:	48425110
Reduced:	F3N3O3C17H26 (1)
Stoich.:	A3B3C3D17E26 (1)
Weight, g/mol:	395.203191
ΔH_f, kcal/mol:	-278.31
Dipole, Da:	6.7
IP(EA), eV:	-8.97(0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1CC1N2CC(CC2=O)C(=O)N3CCN(CC3)CCCOCC(F)(F)F

DOS

IR

Vibrations