Geometry & MOs

Info

ID:	76715
PubChem CID:	48425278
Reduced:	N2O2F4C19H24 (1)
Stoich.:	A2B2C4D19E24 (1)
Weight, g/mol:	348.17731
ΔH_f, kcal/mol:	-258.44
Dipole, Da:	4.72
IP(EA), eV:	-8.79(-0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1CC1(C2=CC=C(C=C2)F)C(=O)N3CCN(CC3)CCCOCC(F)(F)F

DOS

IR

Vibrations