Geometry & MOs

Info

ID:	7455
PubChem CID:	72742
Reduced:	O7H12C16 (1)
Stoich.:	A7B12C16 (1)
Weight, g/mol:	316.058303
ΔH_f, kcal/mol:	-237.5
Dipole, Da:	3.66
IP(EA), eV:	-9.04(-1.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,3,4,5-tetrahydroxy-2-methoxy-7-methylanthracene-9,10-dione

Drug info:

PubChemData

Smile

CC1=CC2=C(C(=C1)O)C(=O)C3=C(C2=O)C(=C(C(=C3O)O)OC)O

DOS

IR

Vibrations