Geometry & MOs

Info

ID:	10033
PubChem CID:	96533
Reduced:	O2H5C7 (2)
Stoich.:	A2B5C7 (2)
Weight, g/mol:	242.057909
ΔH_f, kcal/mol:	-117.08
Dipole, Da:	4.61
IP(EA), eV:	-10.12(-1.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(3-carboxyphenyl)benzoic acid

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations