Geometry & MOs

Info

ID:	76430
PubChem CID:	48424913
Reduced:	N2F3O3C14H25 (1)
Stoich.:	A2B3C3D14E25 (1)
Weight, g/mol:	338.181727
ΔH_f, kcal/mol:	-309.43
Dipole, Da:	2.93
IP(EA), eV:	-8.75(0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC(C)OCC(=O)N1CCN(CC1)CCCOCC(F)(F)F

DOS

IR

Vibrations