Geometry & MOs

Info

ID:	31103
PubChem CID:	854516
Reduced:	O4H14C17 (1)
Stoich.:	A4B14C17 (1)
Weight, g/mol:	320.125988
ΔH_f, kcal/mol:	-99.73
Dipole, Da:	3.66
IP(EA), eV:	-8.86(-1.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 5-[(2S)-1-ethoxy-1-oxopropan-2-yl]oxy-2-methyl-1-benzofuran-3-carboxylate

Drug info:

PubChemData

Smile

CCOC1=CC2=C(C=C1)OC(=C2C(=O)O)C3=CC=CC=C3

DOS

IR

Vibrations