Geometry & MOs

Info

ID:	12004
PubChem CID:	125793
Reduced:	O5H10C12 (1)
Stoich.:	A5B10C12 (1)
Weight, g/mol:	234.052823
ΔH_f, kcal/mol:	-150.07
Dipole, Da:	10.47
IP(EA), eV:	-9.31(-1.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-hydroxy-6-(2-hydroxyphenyl)-2-oxohexa-3,5-dienoic acid

Drug info:

PubChemData

Smile

C1=CC=C(C(=C1)C(=CC=CC(=O)C(=O)O)O)O

DOS

IR

Vibrations