Geometry & MOs

Info

ID:	19586
PubChem CID:	568319
Reduced:	O5C8H14 (1)
Stoich.:	A5B8C14 (1)
Weight, g/mol:	190.084124
ΔH_f, kcal/mol:	-228.26
Dipole, Da:	3.89
IP(EA), eV:	-10.82(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4,5,7-trihydroxyoct-2-enoic acid

Drug info:

PubChemData

Smile

CC(CC(C(C=CC(=O)O)O)O)O

DOS

IR

Vibrations