Geometry & MOs

Info

ID:	383804
PubChem CID:	134975739
Reduced:	SO3C13H14 (1)
Stoich.:	AB3C13D14 (1)
Weight, g/mol:	357.97021
ΔH_f, kcal/mol:	-94.66
Dipole, Da:	6.31
IP(EA), eV:	-9.46(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-(furan-2-yl)-4-hydroxy-5-iodobenzoate

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)S(=O)(=O)C2=C(OC=C2C)C

DOS

IR

Vibrations