Geometry & MOs

Info

ID:	3792
PubChem CID:	10207
Reduced:	OH2C3 (5)
Stoich.:	AB2C3 (5)
Weight, g/mol:	270.052823
ΔH_f, kcal/mol:	-150.23
Dipole, Da:	2.23
IP(EA), eV:	-9.45(-1.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,8-dihydroxy-3-(hydroxymethyl)anthracene-9,10-dione

Drug info:

PubChemData

Smile

C1=CC2=C(C(=C1)O)C(=O)C3=C(C2=O)C=C(C=C3O)CO

DOS

IR

Vibrations