Geometry & MOs

Info

ID:	373017
PubChem CID:	131308643
Reduced:	ClNOSC11H12 (1)
Stoich.:	ABCDE11F12 (1)
Weight, g/mol:	293.9553
ΔH_f, kcal/mol:	-26.52
Dipole, Da:	4.93
IP(EA), eV:	-7.97(-0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-fluoro-2-iodo-3-methoxyphenyl)ethanone

Drug info:

PubChemData

Smile

CCOC1=C2C(=CC=C1)SC(=C2N)CCl

DOS

IR

Vibrations