Geometry & MOs

Info

ID:	1115
PubChem CID:	3806
Reduced:	O3H6C10 (1)
Stoich.:	A3B6C10 (1)
Weight, g/mol:	174.031694
ΔH_f, kcal/mol:	-69.5
Dipole, Da:	0.66
IP(EA), eV:	-9.74(-2.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-hydroxynaphthalene-1,4-dione

Drug info:

PubChemData

Smile

C1=CC2=C(C(=O)C=CC2=O)C(=C1)O

DOS

IR

Vibrations