Geometry & MOs

Info

ID:	31102
PubChem CID:	854515
Reduced:	O6C15H16 (1)
Stoich.:	A6B15C16 (1)
Weight, g/mol:	282.089209
ΔH_f, kcal/mol:	-227.03
Dipole, Da:	8.14
IP(EA), eV:	-9.35(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-ethoxy-2-phenyl-1-benzofuran-3-carboxylic acid

Drug info:

PubChemData

Smile

CC1=C(C2=C(O1)C=CC(=C2)OCC(=O)O)C(=O)OC(C)C

DOS

IR

Vibrations