Geometry & MOs

Info

ID:	283317
PubChem CID:	103973796
Reduced:	O2C5H8 (2)
Stoich.:	A2B5C8 (2)
Weight, g/mol:	292.131074
ΔH_f, kcal/mol:	-181.74
Dipole, Da:	4.23
IP(EA), eV:	-9.9(0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-ethoxy-2-methyl-2-[(5-methyl-2,3-dihydro-1-benzofuran-2-yl)methyl]-3-oxopropanoic acid

Drug info:

PubChemData

Smile

CCOC(=O)C(C)(C/C=C/C)C(=O)O

DOS

IR

Vibrations