Geometry & MOs

Info

ID:

218570

PubChem CID:

85089632

Reduced:

FNSO8C22H24 (1)

Stoich.:

ABCD8E22F24 (1)

Weight, g/mol:

481.1849

ΔHf, kcal/mol:

-318.49

Dipole, Da:

3.75

IP(EA), eV:

 -9.5(-1.31)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

4-(dimethylamino)-10,12a-dihydroxy-7-[3-(methylamino)prop-1-ynyl]-1,3,11,12-tetraoxo-4,4a,5,5a,6,11a-hexahydrotetracene-2-carboxamide

Drug info:

PubChemData

Smile

CC(=O)OCC1=C(N2C(C(C2=O)OC)S(=O)(=O)C1=CC3=CC=CC=C3F)C(=O)OC(C)(C)C

DOS

IR

Vibrations