Geometry & MOs

Info

ID:	76559
PubChem CID:	48425080
Reduced:	F3N3O4C14H24 (1)
Stoich.:	A3B3C4D14E24 (1)
Weight, g/mol:	354.213027
ΔH_f, kcal/mol:	-348.89
Dipole, Da:	3.49
IP(EA), eV:	-8.93(0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-methylpropoxy)-1-[4-[3-(2,2,2-trifluoroethoxy)propyl]piperazin-1-yl]propan-1-one

Drug info:

PubChemData

Smile

CCOC(=O)NCC(=O)N1CCN(CC1)CCCOCC(F)(F)F

DOS

IR

Vibrations