Geometry & MOs

Info

ID:	31104
PubChem CID:	854518
Reduced:	O6C17H20 (1)
Stoich.:	A6B17C20 (1)
Weight, g/mol:	306.110338
ΔH_f, kcal/mol:	-231.95
Dipole, Da:	2.94
IP(EA), eV:	-8.99(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCOC(=O)C1=C(OC2=C1C=C(C=C2)O[C@@H](C)C(=O)OCC)C

DOS

IR

Vibrations