Geometry & MOs

Info

ID:	18470
PubChem CID:	541409
Reduced:	O4H9C17 (2)
Stoich.:	A4B9C17 (2)
Weight, g/mol:	554.100168
ΔH_f, kcal/mol:	-148.06
Dipole, Da:	0.92
IP(EA), eV:	-8.67(-2.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(18-acetyloxy-6,11,12,17-tetraoxotrinaphthylen-5-yl) acetate

Drug info:

PubChemData

Smile

CC(=O)OC1=C2C3=C(C4=C(C2=C(C5=CC=CC=C51)OC(=O)C)C(=O)C6=CC=CC=C6C4=O)C(=O)C7=CC=CC=C7C3=O

DOS

IR

Vibrations