Geometry & MOs

Info

ID:

186488

PubChem CID:

77439128

Reduced:

OC3H4 (13)

Stoich.:

AB3C4 (13)

Weight, g/mol:

583.241746

ΔHf, kcal/mol:

-520.42

Dipole, Da:

11.24

IP(EA), eV:

 -9.69(-0.61)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

7-[5,6-dimethyl-4-(propan-2-ylamino)oxan-2-yl]oxy-6,9,11-trihydroxy-9-(2-hydroxyacetyl)-4-methoxy-8,10-dihydro-7H-tetracene-5,12-dione

Drug info:

PubChemData

Smile

CC1=C2C(C(=O)C3(C(CC4C(C3C(C(C2(C)C)(CC1OC(=O)C(C(C)C)OC(C)C)O)OC(=O)C5=CC=CC=C5)(CO4)OC(=O)C)O)C)OC(=O)C

DOS

IR

Vibrations