Geometry & MOs

Info

ID:	76472
PubChem CID:	48424966
Reduced:	SF3N3O3C17H30 (1)
Stoich.:	AB3C3D3E17F30 (1)
Weight, g/mol:	374.181727
ΔH_f, kcal/mol:	-316.76
Dipole, Da:	1.97
IP(EA), eV:	-8.63(0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3-ethoxyphenyl)-[4-[3-(2,2,2-trifluoroethoxy)propyl]piperazin-1-yl]methanone

Drug info:

PubChemData

Smile

CCC(=O)NC(CCSC)C(=O)N1CCN(CC1)CCCOCC(F)(F)F

DOS

IR

Vibrations