Geometry & MOs

Info

ID:	1526
PubChem CID:	4645
Reduced:	N2O9C22H24 (1)
Stoich.:	A2B9C22D24 (1)
Weight, g/mol:	460.14818
ΔH_f, kcal/mol:	-349.9
Dipole, Da:	0.88
IP(EA), eV:	-9.2(-1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[amino(hydroxy)methylidene]-4-(dimethylamino)-5,6,10,11,12a-pentahydroxy-6-methyl-4,4a,5,5a-tetrahydrotetracene-1,3,12-trione

Drug info:

PubChemData

Smile

CC1(C2C(C3C(C(=O)C(=C(N)O)C(=O)C3(C(=O)C2=C(C4=C1C=CC=C4O)O)O)N(C)C)O)O

DOS

IR

Vibrations