Geometry & MOs

Info

ID:	220624
PubChem CID:	85198080
Reduced:	O11C12H22 (1)
Stoich.:	A11B12C22 (1)
Weight, g/mol:	342.110338
ΔH_f, kcal/mol:	-483.65
Dipole, Da:	3.48
IP(EA), eV:	-10.4(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-acetyl-3,8-dihydroxy-3-(2-oxopropyl)-2,4-dihydro-1H-anthracene-9,10-dione

Drug info:

PubChemData

Smile

C(C(C(C(C(CO)O)OC1C(C(C(C(O1)C=O)O)O)O)O)O)O

DOS

IR

Vibrations