Geometry & MOs

Info

ID:

189924

PubChem CID:

77923508

Reduced:

O2N5C42H55 (1)

Stoich.:

A2B5C42D55 (1)

Weight, g/mol:

521.227434

ΔHf, kcal/mol:

-29.16

Dipole, Da:

5.7

IP(EA), eV:

 -8.63(-0.2)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

4,7-bis(dimethylamino)-3,10,12-trihydroxy-1,11-dioxo-9-pyrimidin-2-yl-4,4a,5,5a,6,10,10a,12a-octahydrotetracene-2-carboxamide

Drug info:

PubChemData

Smile

CC1CCCC(N1CCCN2C3CC4C(CC3N=C2C5=CC(=CC=C5)OC6=CC=C(C=C6)C(C)(C)C)NC(=O)C(N4)CC7=CC=CC=C7)C

DOS

IR

Vibrations