Geometry & MOs

Info

ID:	219618
PubChem CID:	85154872
Reduced:	BrO3N5C24H26 (1)
Stoich.:	AB3C5D24E26 (1)
Weight, g/mol:	514.147512
ΔH_f, kcal/mol:	5.8
Dipole, Da:	4.23
IP(EA), eV:	-8.84(-1.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(4,5-dihydroxy-6-methyloxan-2-yl)oxy-2,5,7-trihydroxy-3-methoxy-2-methyl-3,4-dihydrotetracene-1,6,11-trione

Drug info:

PubChemData

Smile

C1COCCN1CC2=CC(=NC3=C4C(=NC=C3)C=C(C=N4)Br)C(=O)C(=C2)CN5CCOCC5

DOS

IR

Vibrations