Geometry & MOs

Info

ID:	76569
PubChem CID:	48425101
Reduced:	SF3N3O4C13H24 (1)
Stoich.:	AB3C3D4E13F24 (1)
Weight, g/mol:	339.176976
ΔH_f, kcal/mol:	-336.26
Dipole, Da:	4.01
IP(EA), eV:	-8.77(0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-methyl-N-[2-oxo-2-[4-[3-(2,2,2-trifluoroethoxy)propyl]piperazin-1-yl]ethyl]acetamide

Drug info:

PubChemData

Smile

CN(CC(=O)N1CCN(CC1)CCCOCC(F)(F)F)S(=O)(=O)C

DOS

IR

Vibrations