Geometry & MOs

Info

ID:	2695
PubChem CID:	8318
Reduced:	NO3H11C21 (2)
Stoich.:	AB3C11D21 (2)
Weight, g/mol:	650.147786
ΔH_f, kcal/mol:	17.31
Dipole, Da:	2.44
IP(EA), eV:	-7.69(-2.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(9,10-dihydroxyanthracen-1-yl)imino-4-(9,10-dioxoanthracen-1-yl)iminoanthracene-9,10-dione

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C(=C3C=CC=C(C3=C2O)N=C4C=CC(=NC5=CC=CC6=C5C(=O)C7=CC=CC=C7C6=O)C8=C4C(=O)C9=CC=CC=C9C8=O)O

DOS

IR

Vibrations