Geometry & MOs

Info

ID:	76576
PubChem CID:	48425109
Reduced:	N2F3O3C18H25 (1)
Stoich.:	A2B3C3D18E25 (1)
Weight, g/mol:	377.192626
ΔH_f, kcal/mol:	-269.49
Dipole, Da:	0.4
IP(EA), eV:	-8.96(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

COCC1=CC=CC=C1C(=O)N2CCN(CC2)CCCOCC(F)(F)F

DOS

IR

Vibrations