Geometry & MOs

Info

ID:

185854

PubChem CID:

77360686

Reduced:

N3O9C29H37 (1)

Stoich.:

A3B9C29D37 (1)

Weight, g/mol:

587.239828

ΔHf, kcal/mol:

-338.98

Dipole, Da:

12.3

IP(EA), eV:

 -8.74(-1.44)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

7-chloro-8-[(cycloheptylmethylamino)methyl]-4-(dimethylamino)-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)CN5CCCC5CCO)OC

DOS

IR

Vibrations