Geometry & MOs

Info

ID:	8149
PubChem CID:	75165
Reduced:	O3H14C18 (1)
Stoich.:	A3B14C18 (1)
Weight, g/mol:	278.094294
ΔH_f, kcal/mol:	-61.56
Dipole, Da:	2.96
IP(EA), eV:	-8.5(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4-hydroxy-2-methylnaphthalen-1-yl) benzoate

Drug info:

PubChemData

Smile

CC1=C(C2=CC=CC=C2C(=C1)O)OC(=O)C3=CC=CC=C3

DOS

IR

Vibrations