Geometry & MOs

Info

ID:	3791
PubChem CID:	10205
Reduced:	O3H8C11 (1)
Stoich.:	A3B8C11 (1)
Weight, g/mol:	188.047344
ΔH_f, kcal/mol:	-70.17
Dipole, Da:	2.52
IP(EA), eV:	-9.63(-1.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-hydroxy-2-methylnaphthalene-1,4-dione

Drug info:

PubChemData

Smile

CC1=CC(=O)C2=C(C1=O)C=CC=C2O

DOS

IR

Vibrations