Geometry & MOs

Info

ID:	204997
PubChem CID:	80041921
Reduced:	O2F3N3H8C11 (1)
Stoich.:	A2B3C3D8E11 (1)
Weight, g/mol:	308.060647
ΔH_f, kcal/mol:	-159.15
Dipole, Da:	4.6
IP(EA), eV:	-9.35(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-amino-2-sulfanylideneethyl)-N-ethyl-2-fluoro-5-(trifluoromethyl)benzamide

Drug info:

PubChemData

Smile

C1=CC(=C(C=C1C(F)(F)F)C(=O)NC2=CON=C2)N

DOS

IR

Vibrations