Geometry & MOs

Info

ID:	269293
PubChem CID:	103616777
Reduced:	F2N2O2C13H14 (1)
Stoich.:	A2B2C2D13E14 (1)
Weight, g/mol:	465.97529
ΔH_f, kcal/mol:	-168.73
Dipole, Da:	2.5
IP(EA), eV:	-9.55(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-bromo-N-[1-(dimethylamino)-4-methyl-1-oxopentan-2-yl]-2-iodobenzamide

Drug info:

PubChemData

Smile

C1CC(=O)N(C(=O)C1)CC(C2=C(C=CC(=C2)F)F)N

DOS

IR

Vibrations