Geometry & MOs

Info

ID:	2890
PubChem CID:	8788
Reduced:	O4C11H12 (1)
Stoich.:	A4B11C12 (1)
Weight, g/mol:	208.073559
ΔH_f, kcal/mol:	-159.99
Dipole, Da:	6.58
IP(EA), eV:	-10.02(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-oxo-4-phenylmethoxybutanoic acid

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)COC(=O)CCC(=O)O

DOS

IR

Vibrations