Geometry & MOs

Info

ID:	446641
PubChem CID:	135276597
Reduced:	OH3C4 (4)
Stoich.:	AB3C4 (4)
Weight, g/mol:	198.089209
ΔH_f, kcal/mol:	-84.58
Dipole, Da:	3.44
IP(EA), eV:	-9.38(-1.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(1E)-cycloocten-1-yl]oxy-2-oxoacetic acid

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C=C(C2=CC=CC=C2)OC(=O)C(=O)O

DOS

IR

Vibrations