Geometry & MOs

Info

ID:	251138
PubChem CID:	103101713
Reduced:	ClON3C10H14 (1)
Stoich.:	ABC3D10E14 (1)
Weight, g/mol:	260.077262
ΔH_f, kcal/mol:	-25.54
Dipole, Da:	6.97
IP(EA), eV:	-9.46(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-amino-2-oxoethyl)-N-ethyl-3,4,5-trifluorobenzamide

Drug info:

PubChemData

Smile

CCN(CC1=CN=C(C=C1)Cl)CC(=O)N

DOS

IR

Vibrations