Geometry & MOs

Info

ID:	294
PubChem CID:	2525
Reduced:	IOC9H17 (2)
Stoich.:	ABC9D17 (2)
Weight, g/mol:	536.06482
ΔH_f, kcal/mol:	-139.16
Dipole, Da:	7.87
IP(EA), eV:	-9.69(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

9,12-diiodooctadecanoic acid

Drug info:

PubChemData

Smile

CCCCCCC(CCC(CCCCCCCC(=O)O)I)I

DOS

IR

Vibrations