Geometry & MOs

Info

ID:

185850

PubChem CID:

77360067

Reduced:

FN3O8C28H34 (1)

Stoich.:

AB3C8D28E34 (1)

Weight, g/mol:

545.253729

ΔHf, kcal/mol:

-360.8

Dipole, Da:

8.27

IP(EA), eV:

 -8.76(-1.28)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

8-[[tert-butyl(ethyl)amino]methyl]-4-(dimethylamino)-7-fluoro-1,10,11,12a-tetrahydroxy-3,12-dioxo-4a,5,5a,6-tetrahydro-4H-tetracene-2-carboxamide

Drug info:

PubChemData

Smile

CN(C)C1C2CC3CC4=C(C(=CC(=C4C(=C3C(=O)C2(C(=C(C1=O)C(=O)N)O)O)O)O)CN5CCC(CC5)CO)F

DOS

IR

Vibrations