Geometry & MOs

Info

ID:	196903
PubChem CID:	78894155
Reduced:	FSO3N4C18H19 (1)
Stoich.:	ABC3D4E18F19 (1)
Weight, g/mol:	288.144948
ΔH_f, kcal/mol:	-99.98
Dipole, Da:	4.79
IP(EA), eV:	-9.32(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[benzyl(ethyl)amino]-N-methyl-N-(2,2,2-trifluoroethyl)acetamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)C)S(=O)(=O)NCCNC(=O)NC2=C(C=C(C=C2)F)C#N

DOS

IR

Vibrations