Geometry & MOs

Info

ID:	336715
PubChem CID:	127255722
Reduced:	IO2H9C10 (1)
Stoich.:	AB2C9D10 (1)
Weight, g/mol:	287.96473
ΔH_f, kcal/mol:	-34.4
Dipole, Da:	3.89
IP(EA), eV:	-9.18(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-iodo-4-methoxy-2,3-dihydroinden-1-one

Drug info:

PubChemData

Smile

COC1=C(C=CC2=C1CCC2=O)I

DOS

IR

Vibrations