Geometry & MOs

Info

ID:	76564
PubChem CID:	48425090
Reduced:	SF3N3O4C16H28 (1)
Stoich.:	AB3C3D4E16F28 (1)
Weight, g/mol:	352.197377
ΔH_f, kcal/mol:	-344.27
Dipole, Da:	7.88
IP(EA), eV:	-8.82(0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CS(=O)(=O)N1CCCC(C1)C(=O)N2CCN(CC2)CCCOCC(F)(F)F

DOS

IR

Vibrations