Geometry & MOs

Info

ID:	143553
PubChem CID:	53226794
Reduced:	OH7C9 (2)
Stoich.:	AB7C9 (2)
Weight, g/mol:	262.09938
ΔH_f, kcal/mol:	-34.06
Dipole, Da:	1.81
IP(EA), eV:	-8.93(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methyl-4-naphthalen-2-ylbenzoic acid

Drug info:

PubChemData

Smile

CC1=C(C(=CC=C1)C2=CC3=CC=CC=C3C=C2)C(=O)O

DOS

IR

Vibrations