Geometry & MOs

Info

ID:	149189
PubChem CID:	53788861
Reduced:	IO3C12H23 (1)
Stoich.:	AB3C12D23 (1)
Weight, g/mol:	342.06919
ΔH_f, kcal/mol:	-168.45
Dipole, Da:	1.23
IP(EA), eV:	-10.12(-1.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

octyl 3-hydroxy-4-iodobutanoate

Drug info:

PubChemData

Smile

CCCCCCCCOC(=O)C[C@H](CI)O

DOS

IR

Vibrations