Geometry & MOs

Info

ID:	1028
PubChem CID:	3685
Reduced:	NO9C26H27 (1)
Stoich.:	AB9C26D27 (1)
Weight, g/mol:	497.168581
ΔH_f, kcal/mol:	-348.61
Dipole, Da:	7.05
IP(EA), eV:	-9.34(-2.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

9-acetyl-7-(4-amino-5-hydroxy-6-methyloxan-2-yl)oxy-6,9,11-trihydroxy-8,10-dihydro-7H-tetracene-5,12-dione

Drug info:

PubChemData

Smile

CC1C(C(CC(O1)OC2CC(CC3=C2C(=C4C(=C3O)C(=O)C5=CC=CC=C5C4=O)O)(C(=O)C)O)N)O

DOS

IR

Vibrations