Geometry & MOs

Info

ID:	76711
PubChem CID:	48425274
Reduced:	F3N3O4C19H26 (1)
Stoich.:	A3B3C4D19E26 (1)
Weight, g/mol:	388.197377
ΔH_f, kcal/mol:	-325.01
Dipole, Da:	3.18
IP(EA), eV:	-9.02(0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3-ethylphenoxy)-1-[4-[3-(2,2,2-trifluoroethoxy)propyl]piperazin-1-yl]ethanone

Drug info:

PubChemData

Smile

C1CN(CCN1CCCOCC(F)(F)F)C(=O)CN2C(=O)C3CC=CCC3C2=O

DOS

IR

Vibrations