Geometry & MOs

Info

ID:	20383
PubChem CID:	583652
Reduced:	OH3C4 (4)
Stoich.:	AB3C4 (4)
Weight, g/mol:	268.073559
ΔH_f, kcal/mol:	-106.72
Dipole, Da:	5.56
IP(EA), eV:	-9.79(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-(2-carboxyphenyl)ethenyl]benzoic acid

Drug info:

PubChemData

Smile

C1=CC=C(C(=C1)C=CC2=CC=CC=C2C(=O)O)C(=O)O

DOS

IR

Vibrations