Geometry & MOs

Info

ID:	261002
PubChem CID:	103213744
Reduced:	OF3N3C11H16 (1)
Stoich.:	AB3C3D11E16 (1)
Weight, g/mol:	389.90752
ΔH_f, kcal/mol:	-188.05
Dipole, Da:	3.51
IP(EA), eV:	-8.92(0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3-chloro-4-iodophenyl)-2-(2-chlorophenyl)ethanone

Drug info:

PubChemData

Smile

CN1C2=C(CC(CC2)N)N=C1COCC(F)(F)F

DOS

IR

Vibrations