Geometry & MOs

Info

ID:	373225
PubChem CID:	131311876
Reduced:	FIO2C10H10 (1)
Stoich.:	ABC2D10E10 (1)
Weight, g/mol:	305.97529
ΔH_f, kcal/mol:	-92.06
Dipole, Da:	2.88
IP(EA), eV:	-9.21(-1.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-ethoxy-6-iodo-4-methylbenzoic acid

Drug info:

PubChemData

Smile

CCOC1=C(C=C(C(=C1)C(=O)C)F)I

DOS

IR

Vibrations