Geometry & MOs

Info

ID:	391819
PubChem CID:	135009854
Reduced:	LiNF3H5C10 (1)
Stoich.:	ABC3D5E10 (1)
Weight, g/mol:	315.071842
ΔH_f, kcal/mol:	-84.57
Dipole, Da:	9.73
IP(EA), eV:	-7.54(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-oxo-2-(N-[(E)-4,4,4-trifluoro-3-oxobut-1-enyl]anilino)acetate

Drug info:

PubChemData

Smile

[Li+].C1=CC=C2C(=C1)[C-]=CC(=N2)C(F)(F)F

DOS

IR

Vibrations