Geometry & MOs

Info

ID:	336768
PubChem CID:	127255775
Reduced:	FIO2H8C9 (1)
Stoich.:	ABC2D8E9 (1)
Weight, g/mol:	293.9553
ΔH_f, kcal/mol:	-102.69
Dipole, Da:	2.67
IP(EA), eV:	-9.63(-1.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(3-fluoro-5-iodophenyl)propanoic acid

Drug info:

PubChemData

Smile

C1=CC(=C(C=C1CCC(=O)O)F)I

DOS

IR

Vibrations