Geometry & MOs

Info

ID:	269646
PubChem CID:	103618449
Reduced:	IF2N2O2H9C14 (1)
Stoich.:	AB2C2D2E9F14 (1)
Weight, g/mol:	477.90007
ΔH_f, kcal/mol:	-108.07
Dipole, Da:	4.49
IP(EA), eV:	-9.48(-1.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-bromo-2-iodo-N-methyl-N-[2-oxo-2-(2,2,2-trifluoroethylamino)ethyl]benzamide

Drug info:

PubChemData

Smile

C1=CC(=C(C=C1C(=O)N)NC(=O)C2=C(C=C(C=C2)F)I)F

DOS

IR

Vibrations