Geometry & MOs

Info

ID:

215270

PubChem CID:

85084459

Reduced:

N3O3C22H39 (2)

Stoich.:

A3B3C22D39 (2)

Weight, g/mol:

787.305135

ΔHf, kcal/mol:

-386.67

Dipole, Da:

3.49

IP(EA), eV:

 -8.55(0.51)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

7-[4-(dimethylamino)-5-[4-hydroxy-5-(6-hydroxy-5-oxooxan-2-yl)oxy-6-methyloxan-2-yl]oxy-6-methyloxan-2-yl]oxy-9-ethyl-4,6,9,10,11-pentahydroxy-8,10-dihydro-7H-tetracene-5,12-dione

Drug info:

PubChemData

Smile

CCCCCCCCCCCCCCCCCC(=O)NC(CCCCN)C(=O)NC(C(C)C)C(=O)NC(CC1=CC=C(C=C1)O)C(=O)NC(CC(C)C)C(=O)N

DOS

IR

Vibrations