Geometry & MOs

Info

ID:	336476
PubChem CID:	127255483
Reduced:	ClO3H9C11 (1)
Stoich.:	AB3C9D11 (1)
Weight, g/mol:	226.062994
ΔH_f, kcal/mol:	-105.72
Dipole, Da:	4.2
IP(EA), eV:	-9.88(-1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,6-dihydroxy-10H-anthracen-9-one

Drug info:

PubChemData

Smile

COC(=O)C1CC2=C(C1=O)C(=CC=C2)Cl

DOS

IR

Vibrations