Geometry & MOs

Info

ID:	148755
PubChem CID:	53788424
Reduced:	NOF4C19H19 (1)
Stoich.:	ABC4D19E19 (1)
Weight, g/mol:	448.14744
ΔH_f, kcal/mol:	-187.75
Dipole, Da:	4.57
IP(EA), eV:	-9.85(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-hydroxy-14-iodoicosa-5,8,11-trienoic acid

Drug info:

PubChemData

Smile

C1CC(CCC1C=CC=C(C#N)F)OCC2=CC=C(C=C2)C(F)(F)F

DOS

IR

Vibrations