Geometry & MOs

Info

ID:	4493
PubChem CID:	11496
Reduced:	O3H8C9 (1)
Stoich.:	A3B8C9 (1)
Weight, g/mol:	164.047344
ΔH_f, kcal/mol:	-91.39
Dipole, Da:	4.05
IP(EA), eV:	-9.52(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(3-hydroxyphenyl)prop-2-enoic acid

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations